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Isocyanater

Organiske forbindelser, der indeholder et nitrogenatom bundet til et carbonatom, der er bundet til et oxygenatom, begge bindinger er dobbeltbindinger, i følgende struktur: RN=C=O, hvor R er en hvilken som helst carbonkæde eller gruppe.

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1

3-nitrophenylisocyanat, 97 %, Thermo Scientific Chemicals

CAS: 3320-87-4 Molekylær formel: C7H4N2O3 Molekylvægt (g/mol): 164.12 MDL nummer: MFCD00007220 InChI nøgle: GFFGYTMCNVMFAJ-UHFFFAOYSA-N Synonym: 3-nitrophenyl isocyanate,m-nitrophenyl isocyanate,benzene, 1-isocyanato-3-nitro,3-nitrophenylisocyanate,isocyanic acid, m-nitrophenyl ester,3-nitrobenzenisocyanate,m-nitrophenylisocyanate,3-nitropheny isocyanate,pubchem15729,acmc-1ckin PubChem CID: 76835 IUPAC navn: 1-isocyanato-3-nitrobenzen SMIL: [O-][N+](=O)C1=CC=CC(=C1)N=C=O

MDL nummer MFCD00007220
PubChem CID 76835
Molekylvægt (g/mol) 164.12
CAS 3320-87-4
Synonym 3-nitrophenyl isocyanate,m-nitrophenyl isocyanate,benzene, 1-isocyanato-3-nitro,3-nitrophenylisocyanate,isocyanic acid, m-nitrophenyl ester,3-nitrobenzenisocyanate,m-nitrophenylisocyanate,3-nitropheny isocyanate,pubchem15729,acmc-1ckin
SMIL [O-][N+](=O)C1=CC=CC(=C1)N=C=O
IUPAC navn 1-isocyanato-3-nitrobenzen
InChI nøgle GFFGYTMCNVMFAJ-UHFFFAOYSA-N
Molekylær formel C7H4N2O3
2

1-octylisocyanat, 97 %, Thermo Scientific Chemicals

CAS: 3158-26-7 Molekylær formel: C9H17NO Molekylvægt (g/mol): 155.241 MDL nummer: MFCD00013887 InChI nøgle: DYQFCTCUULUMTQ-UHFFFAOYSA-N Synonym: octyl isocyanate,octylisocyanate,octane, 1-isocyanato,n-octylisocyanate,1-octyl isocyanate,n-octyl isocyanate,1-isocyanato-octane,isocyanic acid, octyl ester,octanisocyanate PubChem CID: 76616 IUPAC navn: 1-isocyanatoctan SMIL: CCCCCCCCN=C=O

MDL nummer MFCD00013887
PubChem CID 76616
Molekylvægt (g/mol) 155.241
CAS 3158-26-7
Synonym octyl isocyanate,octylisocyanate,octane, 1-isocyanato,n-octylisocyanate,1-octyl isocyanate,n-octyl isocyanate,1-isocyanato-octane,isocyanic acid, octyl ester,octanisocyanate
SMIL CCCCCCCCN=C=O
IUPAC navn 1-isocyanatoctan
InChI nøgle DYQFCTCUULUMTQ-UHFFFAOYSA-N
Molekylær formel C9H17NO
3

3-Chloropropyl isocyanate, 97%, Thermo Scientific Chemicals

CAS: 13010-19-0 Molekylær formel: C4H6ClNO Molekylvægt (g/mol): 119.55 MDL nummer: MFCD00010384 InChI nøgle: RQAVSDINDRNIKL-UHFFFAOYSA-N Synonym: 3-chloropropyl isocyanate,3-chloropropylisocyanate,propane, 1-chloro-3-isocyanato,1-chloro-3-isocyanato-propane,chloropropylisocyanate,chloropropyl isocyanate,3-chloropropanisocyanate,chloro propyl isocyanate,acmc-20an5q,3-chloropropyl-isocyanate PubChem CID: 166752 IUPAC navn: 1-chlor-3-isocyanatopropan SMIL: ClCCCN=C=O

MDL nummer MFCD00010384
PubChem CID 166752
Molekylvægt (g/mol) 119.55
CAS 13010-19-0
Synonym 3-chloropropyl isocyanate,3-chloropropylisocyanate,propane, 1-chloro-3-isocyanato,1-chloro-3-isocyanato-propane,chloropropylisocyanate,chloropropyl isocyanate,3-chloropropanisocyanate,chloro propyl isocyanate,acmc-20an5q,3-chloropropyl-isocyanate
SMIL ClCCCN=C=O
IUPAC navn 1-chlor-3-isocyanatopropan
InChI nøgle RQAVSDINDRNIKL-UHFFFAOYSA-N
Molekylær formel C4H6ClNO
4
Kampagner er tilgængelige

4-Cyanophenyl isocyanate, 95%, Thermo Scientific Chemicals

CAS: 40465-45-0 Molekylær formel: C8H4N2O Molekylvægt (g/mol): 144.13 MDL nummer: MFCD00037038 InChI nøgle: TVSXDZNUTPLDKY-UHFFFAOYSA-N PubChem CID: 170380 IUPAC navn: 4-isocyanatobenzonitril SMIL: C1=CC(=CC=C1C#N)N=C=O

MDL nummer MFCD00037038
PubChem CID 170380
Molekylvægt (g/mol) 144.13
CAS 40465-45-0
SMIL C1=CC(=CC=C1C#N)N=C=O
IUPAC navn 4-isocyanatobenzonitril
InChI nøgle TVSXDZNUTPLDKY-UHFFFAOYSA-N
Molekylær formel C8H4N2O
5
Kampagner er tilgængelige

Isophoron diisocyanat, 98%, Thermo Scientific Chemicals

CAS: 4098-71-9 Molekylær formel: C12H18N2O2 Molekylvægt (g/mol): 222.29 MDL nummer: MFCD00064956 InChI nøgle: NIMLQBUJDJZYEJ-UHFFFAOYNA-N Synonym: isophorone diisocyanate,ipdi,isophorone diamine diisocyanate,5-isocyanato-1-isocyanatomethyl-1,3,3-trimethylcyclohexane,3-isocyanatomethyl-3,5,5-trimethylcyclohexylisocyanate,cyclohexane, 5-isocyanato-1-isocyanatomethyl-1,3,3-trimethyl,3-isocyanatomethyl-3,5,5-trimethylcyclohexyl isocyanate,ccris 6252,isocyanic acid, methylene 3,5,5-trimethyl-3,1-cyclohexylene ester,isophorone diisocyanate diisocyanates PubChem CID: 169132 ChEBI: CHEBI:53214 IUPAC navn: 5-isocyanato-1-(isocyanatomethyl)-1,3,3-trimethylcyclohexan SMIL: CC1(C)CC(CC(C)(CN=C=O)C1)N=C=O

MDL nummer MFCD00064956
PubChem CID 169132
Molekylvægt (g/mol) 222.29
CAS 4098-71-9
ChEBI CHEBI:53214
Synonym isophorone diisocyanate,ipdi,isophorone diamine diisocyanate,5-isocyanato-1-isocyanatomethyl-1,3,3-trimethylcyclohexane,3-isocyanatomethyl-3,5,5-trimethylcyclohexylisocyanate,cyclohexane, 5-isocyanato-1-isocyanatomethyl-1,3,3-trimethyl,3-isocyanatomethyl-3,5,5-trimethylcyclohexyl isocyanate,ccris 6252,isocyanic acid, methylene 3,5,5-trimethyl-3,1-cyclohexylene ester,isophorone diisocyanate diisocyanates
SMIL CC1(C)CC(CC(C)(CN=C=O)C1)N=C=O
IUPAC navn 5-isocyanato-1-(isocyanatomethyl)-1,3,3-trimethylcyclohexan
InChI nøgle NIMLQBUJDJZYEJ-UHFFFAOYNA-N
Molekylær formel C12H18N2O2
6

Allylisocyanat, 96 %, Thermo Scientific Chemicals

CAS: 1476-23-9 Molekylær formel: C4H5NO Molekylvægt (g/mol): 83.09 MDL nummer: MFCD00002044 InChI nøgle: HXBPYFMVGFDZFT-UHFFFAOYSA-N PubChem CID: 15123 IUPAC navn: 3-isocyanatoprop-1-en SMIL: C=CCN=C=O

MDL nummer MFCD00002044
PubChem CID 15123
Molekylvægt (g/mol) 83.09
CAS 1476-23-9
SMIL C=CCN=C=O
IUPAC navn 3-isocyanatoprop-1-en
InChI nøgle HXBPYFMVGFDZFT-UHFFFAOYSA-N
Molekylær formel C4H5NO
7

Benzylisocyanat, 99+%, Thermo Scientific Chemicals

CAS: 3173-56-6 Molekylær formel: C8H7NO Molekylvægt (g/mol): 133.15 MDL nummer: MFCD00009701 InChI nøgle: YDNLNVZZTACNJX-UHFFFAOYSA-N Synonym: benzyl isocyanate,isocyanatomethyl benzene,benzylisocyanate,isocyanic acid benzyl ester,benzene, isocyanatomethyl,1-isocyanatomethyl benzene,phenylmethyl isocyanate,unii-8i2li357gq,phenylmethanisocyanate PubChem CID: 76639 IUPAC navn: isocyanatomethylbenzen SMIL: O=C=NCC1=CC=CC=C1

MDL nummer MFCD00009701
PubChem CID 76639
Molekylvægt (g/mol) 133.15
CAS 3173-56-6
Synonym benzyl isocyanate,isocyanatomethyl benzene,benzylisocyanate,isocyanic acid benzyl ester,benzene, isocyanatomethyl,1-isocyanatomethyl benzene,phenylmethyl isocyanate,unii-8i2li357gq,phenylmethanisocyanate
SMIL O=C=NCC1=CC=CC=C1
IUPAC navn isocyanatomethylbenzen
InChI nøgle YDNLNVZZTACNJX-UHFFFAOYSA-N
Molekylær formel C8H7NO
8

Trichloracetylisocyanat, 97 %, Thermo Scientific Chemicals

CAS: 3019-71-4 Molekylær formel: C3Cl3NO2 Molekylvægt (g/mol): 188.39 MDL nummer: MFCD00002033 InChI nøgle: GRNOZCCBOFGDCL-UHFFFAOYSA-N Synonym: trichloroacetyl isocyanate,acetyl isocyanate, trichloro,trichloroacetylisocyanate,isocyanic acid trichloroacetyl ester,unii-qxv1p5j6jl,qxv1p5j6jl,acetyl isocyanate, 2,2,2-trichloro,2,2,2-trichloroethanecarbonyl isocyanate,trichloroethanecarbonyl isocyanate,trichloroacetyl isocyanate, nmr grade PubChem CID: 76400 SMIL: ClC(Cl)(Cl)C(=O)N=C=O

MDL nummer MFCD00002033
PubChem CID 76400
Molekylvægt (g/mol) 188.39
CAS 3019-71-4
Synonym trichloroacetyl isocyanate,acetyl isocyanate, trichloro,trichloroacetylisocyanate,isocyanic acid trichloroacetyl ester,unii-qxv1p5j6jl,qxv1p5j6jl,acetyl isocyanate, 2,2,2-trichloro,2,2,2-trichloroethanecarbonyl isocyanate,trichloroethanecarbonyl isocyanate,trichloroacetyl isocyanate, nmr grade
SMIL ClC(Cl)(Cl)C(=O)N=C=O
InChI nøgle GRNOZCCBOFGDCL-UHFFFAOYSA-N
Molekylær formel C3Cl3NO2
9

Phenethylisocyanat, 99 %, Thermo Scientific Chemicals

CAS: 1943-82-4 Molekylær formel: C9H9NO Molekylvægt (g/mol): 147.18 MDL nummer: MFCD00037044 InChI nøgle: HACRKYQRZABURO-UHFFFAOYSA-N Synonym: phenethyl isocyanate,2-isocyanatoethyl benzene,phenylethyl isocyanate,2-phenylethyl isocyanate,2-phenylethylisocyanate,phenylethylisocyanate,phenethylisocyanate,benzene, 2-isocyanatoethyl,2-isocyanato-ethyl-benzene,2-phenethyl isocyanate PubChem CID: 160602 ChEBI: CHEBI:60067 IUPAC navn: 2-isocyanatoethylbenzen SMIL: C1=CC=C(C=C1)CCN=C=O

MDL nummer MFCD00037044
PubChem CID 160602
Molekylvægt (g/mol) 147.18
CAS 1943-82-4
ChEBI CHEBI:60067
Synonym phenethyl isocyanate,2-isocyanatoethyl benzene,phenylethyl isocyanate,2-phenylethyl isocyanate,2-phenylethylisocyanate,phenylethylisocyanate,phenethylisocyanate,benzene, 2-isocyanatoethyl,2-isocyanato-ethyl-benzene,2-phenethyl isocyanate
SMIL C1=CC=C(C=C1)CCN=C=O
IUPAC navn 2-isocyanatoethylbenzen
InChI nøgle HACRKYQRZABURO-UHFFFAOYSA-N
Molekylær formel C9H9NO
10

2-chlorethylisocyanat, 97 %, Thermo Scientific Chemicals

CAS: 1943-83-5 Molekylær formel: C3H4ClNO Molekylvægt (g/mol): 105.521 MDL nummer: MFCD00002043 InChI nøgle: BCMYXYHEMGPZJN-UHFFFAOYSA-N Synonym: 2-chloroethyl isocyanate,2-chloroethylisocyanate,chloroethylisocyanate,ethane, 1-chloro-2-isocyanato,2-chlorethylisokyanat,2-chloro ethyl isocyanate,isocyanic acid, 2-chloroethyl ester,1-chloro-2-isocyanato-ethane,2-chlorethylisokyanat czech,.beta.-chloroethylisocyanate PubChem CID: 16035 IUPAC navn: 1-chlor-2-isocyanatoethan SMIL: C(CCl)N=C=O

MDL nummer MFCD00002043
PubChem CID 16035
Molekylvægt (g/mol) 105.521
CAS 1943-83-5
Synonym 2-chloroethyl isocyanate,2-chloroethylisocyanate,chloroethylisocyanate,ethane, 1-chloro-2-isocyanato,2-chlorethylisokyanat,2-chloro ethyl isocyanate,isocyanic acid, 2-chloroethyl ester,1-chloro-2-isocyanato-ethane,2-chlorethylisokyanat czech,.beta.-chloroethylisocyanate
SMIL C(CCl)N=C=O
IUPAC navn 1-chlor-2-isocyanatoethan
InChI nøgle BCMYXYHEMGPZJN-UHFFFAOYSA-N
Molekylær formel C3H4ClNO
11

2,6-dichlorphenylisocyanat, 98 %, Thermo Scientific Chemicals

CAS: 39920-37-1 Molekylær formel: C7H3Cl2NO Molekylvægt (g/mol): 188.007 MDL nummer: MFCD00002003 InChI nøgle: HMVKMAMIRAVXAN-UHFFFAOYSA-N Synonym: 2,6-dichlorophenyl isocyanate,benzene, 1,3-dichloro-2-isocyanato,2,6-dichlorophenylisocyanate,isocyanic acid 2,6-dichlorophenyl ester,pubchem23916,acmc-1ailv,2,6 dichlorophenylisocyanate,2,6-dichlorobenzenisocyanate,2,6dichlorophenyl isocyanate,1,3-dichloro-2-isocyanato-benzene PubChem CID: 604537 IUPAC navn: 1,3-dichlor-2-isocyanatobenzen SMIL: C1=CC(=C(C(=C1)Cl)N=C=O)Cl

MDL nummer MFCD00002003
PubChem CID 604537
Molekylvægt (g/mol) 188.007
CAS 39920-37-1
Synonym 2,6-dichlorophenyl isocyanate,benzene, 1,3-dichloro-2-isocyanato,2,6-dichlorophenylisocyanate,isocyanic acid 2,6-dichlorophenyl ester,pubchem23916,acmc-1ailv,2,6 dichlorophenylisocyanate,2,6-dichlorobenzenisocyanate,2,6dichlorophenyl isocyanate,1,3-dichloro-2-isocyanato-benzene
SMIL C1=CC(=C(C(=C1)Cl)N=C=O)Cl
IUPAC navn 1,3-dichlor-2-isocyanatobenzen
InChI nøgle HMVKMAMIRAVXAN-UHFFFAOYSA-N
Molekylær formel C7H3Cl2NO
12

3-nitrophenylisocyanat, 97 %, Thermo Scientific Chemicals

CAS: 3320-87-4 Molekylær formel: C7H4N2O3 Molekylvægt (g/mol): 164.12 MDL nummer: MFCD00007220 InChI nøgle: GFFGYTMCNVMFAJ-UHFFFAOYSA-N Synonym: 3-nitrophenyl isocyanate,m-nitrophenyl isocyanate,benzene, 1-isocyanato-3-nitro,3-nitrophenylisocyanate,isocyanic acid, m-nitrophenyl ester,3-nitrobenzenisocyanate,m-nitrophenylisocyanate,3-nitropheny isocyanate,pubchem15729,acmc-1ckin PubChem CID: 76835 IUPAC navn: 1-isocyanato-3-nitrobenzen SMIL: [O-][N+](=O)C1=CC=CC(=C1)N=C=O

MDL nummer MFCD00007220
PubChem CID 76835
Molekylvægt (g/mol) 164.12
CAS 3320-87-4
Synonym 3-nitrophenyl isocyanate,m-nitrophenyl isocyanate,benzene, 1-isocyanato-3-nitro,3-nitrophenylisocyanate,isocyanic acid, m-nitrophenyl ester,3-nitrobenzenisocyanate,m-nitrophenylisocyanate,3-nitropheny isocyanate,pubchem15729,acmc-1ckin
SMIL [O-][N+](=O)C1=CC=CC(=C1)N=C=O
IUPAC navn 1-isocyanato-3-nitrobenzen
InChI nøgle GFFGYTMCNVMFAJ-UHFFFAOYSA-N
Molekylær formel C7H4N2O3
13

Ethoxycarbonylisocyanat, 90 %, tek., Thermo Scientific Chemicals

CAS: 19617-43-7 Molekylær formel: C4H5NO3 Molekylvægt (g/mol): 115.09 InChI nøgle: VMVZGGPZNHFGKS-UHFFFAOYSA-N Synonym: ethoxycarbonyl isocyanate,ethyl isocyanatoformate,ethyl carbonisocyanatidate,ethyl n-carbonylcarbamate,ethoxycarbonylisocyanate,carbonisocyanatidic acid, ethyl ester,ethyl isocyanatooate,ethylisocyanatoformate,acmc-20al2o,carbonisocyanatidicacid,ethylester PubChem CID: 300166 IUPAC navn: ethyl-N-(oxomethyliden)carbamat SMIL: CCOC(=O)N=C=O

PubChem CID 300166
Molekylvægt (g/mol) 115.09
CAS 19617-43-7
Synonym ethoxycarbonyl isocyanate,ethyl isocyanatoformate,ethyl carbonisocyanatidate,ethyl n-carbonylcarbamate,ethoxycarbonylisocyanate,carbonisocyanatidic acid, ethyl ester,ethyl isocyanatooate,ethylisocyanatoformate,acmc-20al2o,carbonisocyanatidicacid,ethylester
SMIL CCOC(=O)N=C=O
IUPAC navn ethyl-N-(oxomethyliden)carbamat
InChI nøgle VMVZGGPZNHFGKS-UHFFFAOYSA-N
Molekylær formel C4H5NO3
14

Benzoylisocyanat, 90%, Tech ., Thermo Scientific Chemicals

CAS: 4461-33-0 Molekylær formel: C8H5NO2 Molekylvægt (g/mol): 147.13 MDL nummer: MFCD00002032 InChI nøgle: LURYMYITPCOQAU-UHFFFAOYSA-N Synonym: benzoylisocyanate,methanone, 1-phenyl-1-isocyanato,oxophenylmethanisocyanate,benzoyl isocynate,phconco,acmc-20alpt,pubchem7575,isocyanato phenyl methanone,isocyanato-phenyl-methanone,9ci PubChem CID: 78210 IUPAC navn: benzoylisocyanat SMIL: C1=CC=C(C=C1)C(=O)N=C=O

MDL nummer MFCD00002032
PubChem CID 78210
Molekylvægt (g/mol) 147.13
CAS 4461-33-0
Synonym benzoylisocyanate,methanone, 1-phenyl-1-isocyanato,oxophenylmethanisocyanate,benzoyl isocynate,phconco,acmc-20alpt,pubchem7575,isocyanato phenyl methanone,isocyanato-phenyl-methanone,9ci
SMIL C1=CC=C(C=C1)C(=O)N=C=O
IUPAC navn benzoylisocyanat
InChI nøgle LURYMYITPCOQAU-UHFFFAOYSA-N
Molekylær formel C8H5NO2
15

(S)-(-)-α -Methylbenzylisocyanat, 98%, Thermo Scientific Chemicals

CAS: 14649-03-7 Molekylær formel: C9H9NO Molekylvægt (g/mol): 147.18 MDL nummer: MFCD00002036 InChI nøgle: JJSCUXAFAJEQGB-QMMMGPOBSA-N Synonym: s---1-phenylethyl isocyanate,1s-1-isocyanatoethyl benzene,s---alpha-methylbenzyl isocyanate,benzene, 1s-1-isocyanatoethyl,isocyanic acid s---a-methylbenzyl ester,s-alpha-methylbenzyl isocyanate,s---1-phenylethylisocyanate,isocyanic acid s---alpha-methylbenzyl ester,isocyanic acid s---methylbenzyl ester,1-isocyanatoethyl benzene # PubChem CID: 2724173 IUPAC navn: [(1S)-1-isocyanatoethyl]benzen SMIL: CC(C1=CC=CC=C1)N=C=O

MDL nummer MFCD00002036
PubChem CID 2724173
Molekylvægt (g/mol) 147.18
CAS 14649-03-7
Synonym s---1-phenylethyl isocyanate,1s-1-isocyanatoethyl benzene,s---alpha-methylbenzyl isocyanate,benzene, 1s-1-isocyanatoethyl,isocyanic acid s---a-methylbenzyl ester,s-alpha-methylbenzyl isocyanate,s---1-phenylethylisocyanate,isocyanic acid s---alpha-methylbenzyl ester,isocyanic acid s---methylbenzyl ester,1-isocyanatoethyl benzene #
SMIL CC(C1=CC=CC=C1)N=C=O
IUPAC navn [(1S)-1-isocyanatoethyl]benzen
InChI nøgle JJSCUXAFAJEQGB-QMMMGPOBSA-N
Molekylær formel C9H9NO