Organiske zwitterioner

Organiske zwitterioner (fra tysk Zwitter betyder hermafrodit) er organiske molekyler, der indeholder det samme antal positivt ladede funktionelle grupper og negativt ladede funktionelle grupper; også kaldet indre salte.

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Titanium(IV) ethoxid

CAS: 3087-36-3 Molekylær formel: C₈H₂₀O₄Ti Molekylvægt (g/mol): 228.15 MDL nummer: MFCD00009071 InChI nøgle: JMXKSZRRTHPKDL-UHFFFAOYSA-N Synonym: titanium iv ethoxide,ethyl titanate,titanium tetraethoxide,titanium ethoxide,tetraethyl titanate,titanium iv ethanolate,titanium 4+ tetraethanolate,titanium 4+ ethanolate PubChem CID: 76524 IUPAC navn: ethanolat; titanium(4+) SMIL: CC[O-].CC[O-].CC[O-].CC[O-].[Ti+4]

Pris og tilgængelighed
Tekniske data

MDL nummer	MFCD00009071
PubChem CID	76524
Molekylvægt (g/mol)	228.15
CAS	3087-36-3
Synonym	titanium iv ethoxide,ethyl titanate,titanium tetraethoxide,titanium ethoxide,tetraethyl titanate,titanium iv ethanolate,titanium 4+ tetraethanolate,titanium 4+ ethanolate
SMIL	CC[O-].CC[O-].CC[O-].CC[O-].[Ti+4]
IUPAC navn	ethanolat; titanium(4+)
InChI nøgle	JMXKSZRRTHPKDL-UHFFFAOYSA-N
Molekylær formel	C₈H₂₀O₄Ti

2-nitroimidazol, 98%

CAS: 527-73-1 Molekylær formel: C3H3N3O2 Molekylvægt (g/mol): 113.08 MDL nummer: MFCD00005185 InChI nøgle: YZEUHQHUFTYLPH-UHFFFAOYSA-N Synonym: 2-nitroimidazole,azomycin,amicin,nitroimidazole,1h-imidazole, 2-nitro,imidazole, 2-nitro,2-nitroimidazol,2-nitro-imidazole,unii-k8e96xl55d,azomycin 2-nitroimidazole PubChem CID: 10701 ChEBI: CHEBI:67135 IUPAC navn: 2-nitro-lH-imidazol SMIL: [O-][N+](=O)C1=NC=CN1

Pris og tilgængelighed
Tekniske data

MDL nummer	MFCD00005185
PubChem CID	10701
Molekylvægt (g/mol)	113.08
CAS	527-73-1
ChEBI	CHEBI:67135
Synonym	2-nitroimidazole,azomycin,amicin,nitroimidazole,1h-imidazole, 2-nitro,imidazole, 2-nitro,2-nitroimidazol,2-nitro-imidazole,unii-k8e96xl55d,azomycin 2-nitroimidazole
SMIL	[O-][N+](=O)C1=NC=CN1
IUPAC navn	2-nitro-lH-imidazol
InChI nøgle	YZEUHQHUFTYLPH-UHFFFAOYSA-N
Molekylær formel	C3H3N3O2

Titanium(IV) isopropoxid, 98+%

CAS: 546-68-9 Molekylær formel: C₁₂H₂₈O₄Ti Molekylvægt (g/mol): 284.26 InChI nøgle: VXUYXOFXAQZZMF-UHFFFAOYSA-N Synonym: titanium tetraisopropanolate,titanium iv isopropoxide,tetraisopropyl orthotitanate,titanium isopropoxide,titanium tetraisopropylate,titanium isopropylate,ti isopropylate,tetraisopropoxytitanium iv,isopropyl orthotitanate,tetraisopropyl titanate PubChem CID: 11026 IUPAC navn: propan-2-olat;titanium(4+) SMIL: CC(C)[O-].CC(C)[O-].CC(C)[O-].CC(C)[O-].[Ti+4]

Pris og tilgængelighed
Tekniske data

PubChem CID	11026
Molekylvægt (g/mol)	284.26
CAS	546-68-9
Synonym	titanium tetraisopropanolate,titanium iv isopropoxide,tetraisopropyl orthotitanate,titanium isopropoxide,titanium tetraisopropylate,titanium isopropylate,ti isopropylate,tetraisopropoxytitanium iv,isopropyl orthotitanate,tetraisopropyl titanate
SMIL	CC(C)[O-].CC(C)[O-].CC(C)[O-].CC(C)[O-].[Ti+4]
IUPAC navn	propan-2-olat;titanium(4+)
InChI nøgle	VXUYXOFXAQZZMF-UHFFFAOYSA-N
Molekylær formel	C₁₂H₂₈O₄Ti

2-Nitro-p-phenylendiamin, 95%

CAS: 5307-14-2 Molekylær formel: C6H7N3O2 Molekylvægt (g/mol): 153.141 MDL nummer: MFCD00007903 InChI nøgle: HVHNMNGARPCGGD-UHFFFAOYSA-N Synonym: 2-nitro-1,4-phenylenediamine,1,4-diamino-2-nitrobenzene,2-nitro-p-phenylenediamine,2,5-diaminonitrobenzene,1,4-benzenediamine, 2-nitro,durafur brown,2-nitro-1,4-benzenediamine,o-nitro-p-phenylenediamine,4-amino-2-nitroaniline,fouramine 2r PubChem CID: 4338370 ChEBI: CHEBI:76394 IUPAC navn: 2-nitrobenzen-1,4-diamin SMIL: C1=CC(=C(C=C1N)[N+](=O)[O-])N

Pris og tilgængelighed
Tekniske data

MDL nummer	MFCD00007903
PubChem CID	4338370
Molekylvægt (g/mol)	153.141
CAS	5307-14-2
ChEBI	CHEBI:76394
Synonym	2-nitro-1,4-phenylenediamine,1,4-diamino-2-nitrobenzene,2-nitro-p-phenylenediamine,2,5-diaminonitrobenzene,1,4-benzenediamine, 2-nitro,durafur brown,2-nitro-1,4-benzenediamine,o-nitro-p-phenylenediamine,4-amino-2-nitroaniline,fouramine 2r
SMIL	C1=CC(=C(C=C1N)[N+](=O)[O-])N
IUPAC navn	2-nitrobenzen-1,4-diamin
InChI nøgle	HVHNMNGARPCGGD-UHFFFAOYSA-N
Molekylær formel	C6H7N3O2

Zirkonium(IV) propoxid, ca. 70%, opløsning i 1-propanol, AcroSeal™

CAS: 23519-77-9 Molekylær formel: C12H28O4Zr Molekylvægt (g/mol): 327.58 MDL nummer: MFCD00015307 InChI nøgle: XPGAWFIWCWKDDL-UHFFFAOYSA-N Synonym: zirconium iv tetrapropoxide,zirconium iv propoxide,unii-a7z4n4e80x,1-propanol, zirconium 4+ salt,zirconium propoxide,zirconium n-propoxide,1-propanol, zirconium 4+ salt 4:1,zirconium iv propoxide solution,zirconium tetrapropanolate,propyl alcohol, zirconium 4+ salt PubChem CID: 90139 SMIL: CCCO[Zr](OCCC)(OCCC)OCCC

Pris og tilgængelighed
Tekniske data

MDL nummer	MFCD00015307
PubChem CID	90139
Molekylvægt (g/mol)	327.58
CAS	23519-77-9
Synonym	zirconium iv tetrapropoxide,zirconium iv propoxide,unii-a7z4n4e80x,1-propanol, zirconium 4+ salt,zirconium propoxide,zirconium n-propoxide,1-propanol, zirconium 4+ salt 4:1,zirconium iv propoxide solution,zirconium tetrapropanolate,propyl alcohol, zirconium 4+ salt
SMIL	CCCO[Zr](OCCC)(OCCC)OCCC
InChI nøgle	XPGAWFIWCWKDDL-UHFFFAOYSA-N
Molekylær formel	C12H28O4Zr

2-nitro-2-methyl-1,3-propandiol, 99 %, Thermo Scientific Chemicals

CAS: 77-49-6 Molekylær formel: C4H9NO4 Molekylvægt (g/mol): 135.12 MDL nummer: MFCD00024812 InChI nøgle: LOTYADDQWWVBDJ-UHFFFAOYSA-N Synonym: 2-methyl-2-nitro-1,3-propanediol,nmpd,2-nitro-2-methyl-1,3-propanediol,nitroisobutylglycol,1,3-propanediol, 2-methyl-2-nitro,2-methyl-2-nitropropanediol,1,1-dimethylol-1-nitroethane,caswell no. 573n,epa pesticide chemical code 573900,acmc-1basy PubChem CID: 6480 IUPAC navn: 2-methyl-2-nitropropan-1,3-diol SMIL: CC(CO)(CO)[N+]([O-])=O

Pris og tilgængelighed
Tekniske data

MDL nummer	MFCD00024812
PubChem CID	6480
Molekylvægt (g/mol)	135.12
CAS	77-49-6
Synonym	2-methyl-2-nitro-1,3-propanediol,nmpd,2-nitro-2-methyl-1,3-propanediol,nitroisobutylglycol,1,3-propanediol, 2-methyl-2-nitro,2-methyl-2-nitropropanediol,1,1-dimethylol-1-nitroethane,caswell no. 573n,epa pesticide chemical code 573900,acmc-1basy
SMIL	CC(CO)(CO)[N+]([O-])=O
IUPAC navn	2-methyl-2-nitropropan-1,3-diol
InChI nøgle	LOTYADDQWWVBDJ-UHFFFAOYSA-N
Molekylær formel	C4H9NO4

MDL nummer	MFCD00024812
PubChem CID	6480
Molekylvægt (g/mol)	135.12
CAS	77-49-6
Synonym	2-methyl-2-nitro-1,3-propanediol,nmpd,2-nitro-2-methyl-1,3-propanediol,nitroisobutylglycol,1,3-propanediol, 2-methyl-2-nitro,2-methyl-2-nitropropanediol,1,1-dimethylol-1-nitroethane,caswell no. 573n,epa pesticide chemical code 573900,acmc-1basy
SMIL	CC(CO)(CO)[N+]([O-])=O
IUPAC navn	2-methyl-2-nitropropan-1,3-diol
InChI nøgle	LOTYADDQWWVBDJ-UHFFFAOYSA-N
Molekylær formel	C4H9NO4

2,3-Difluoro-6-nitroaniline, 97%, Thermo Scientific Chemicals

CAS: 211693-73-1 Molekylær formel: C6H4F2N2O2 Molekylvægt (g/mol): 174.11 MDL nummer: MFCD00233313 InChI nøgle: DIPGYZSCGXBTEU-UHFFFAOYSA-N Synonym: 2-amino-3,4-difluoronitrobenzene,2,3-difluoro-6-nitrophenylamine,2,3-difluoro-6-nitrobenzenamine,benzenamine, 2,3-difluoro-6-nitro,acmc-1byjz,5,6-difluoro-2-nitroaniline,ksc495e7r,2,3-difluoro-6-nitro-aniline,buttpark 15\01-97,2,3-difluoro-6-nitro-phenylamine PubChem CID: 2737028 IUPAC navn: 2,3-difluor-6-nitroanilin SMIL: NC1=C(C=CC(F)=C1F)[N+]([O-])=O

Pris og tilgængelighed
Tekniske data

MDL nummer	MFCD00233313
PubChem CID	2737028
Molekylvægt (g/mol)	174.11
CAS	211693-73-1
Synonym	2-amino-3,4-difluoronitrobenzene,2,3-difluoro-6-nitrophenylamine,2,3-difluoro-6-nitrobenzenamine,benzenamine, 2,3-difluoro-6-nitro,acmc-1byjz,5,6-difluoro-2-nitroaniline,ksc495e7r,2,3-difluoro-6-nitro-aniline,buttpark 15\01-97,2,3-difluoro-6-nitro-phenylamine
SMIL	NC1=C(C=CC(F)=C1F)[N+]([O-])=O
IUPAC navn	2,3-difluor-6-nitroanilin
InChI nøgle	DIPGYZSCGXBTEU-UHFFFAOYSA-N
Molekylær formel	C6H4F2N2O2

Titanium(IV) isopropoxid, 99,995% (metalbasis)

CAS: 546-68-9 Molekylær formel: C12H28O4Ti Molekylvægt (g/mol): 284.219 MDL nummer: MFCD00008871 InChI nøgle: VXUYXOFXAQZZMF-UHFFFAOYSA-N Synonym: titanium tetraisopropanolate,titanium iv isopropoxide,tetraisopropyl orthotitanate,titanium isopropoxide,titanium tetraisopropylate,titanium isopropylate,ti isopropylate,tetraisopropoxytitanium iv,isopropyl orthotitanate,tetraisopropyl titanate PubChem CID: 11026 IUPAC navn: propan-2-olat;titanium(4+) SMIL: CC(C)[O-].CC(C)[O-].CC(C)[O-].CC(C)[O-].[Ti+4]

Pris og tilgængelighed
Tekniske data

MDL nummer	MFCD00008871
PubChem CID	11026
Molekylvægt (g/mol)	284.219
CAS	546-68-9
Synonym	titanium tetraisopropanolate,titanium iv isopropoxide,tetraisopropyl orthotitanate,titanium isopropoxide,titanium tetraisopropylate,titanium isopropylate,ti isopropylate,tetraisopropoxytitanium iv,isopropyl orthotitanate,tetraisopropyl titanate
SMIL	CC(C)[O-].CC(C)[O-].CC(C)[O-].CC(C)[O-].[Ti+4]
IUPAC navn	propan-2-olat;titanium(4+)
InChI nøgle	VXUYXOFXAQZZMF-UHFFFAOYSA-N
Molekylær formel	C12H28O4Ti

6-nitro-2(3H)-benzoxazolon, 98%

CAS: 4694-91-1 Molekylær formel: C7H4N2O4 Molekylvægt (g/mol): 180.119 MDL nummer: MFCD00463755 InChI nøgle: JGYJZHYTADCWIK-UHFFFAOYSA-N Synonym: 6-nitrobenzo d oxazol-2 3h-one,6-nitro-2-benzoxazolinone,2 3h-benzoxazolone, 6-nitro,6-nitrobenzoxazolinone,6-nitro benzoxazolinone,6-nitro-3h-benzooxazol-2-one,6-nitrobenzoxazol-2 3h-one,6-nitrobenzoxazolone,6-nitrobenzoxazole-2 3h-one,6-nitro-1,3-benzoxazol-2 3h-one PubChem CID: 78419 IUPAC navn: 6-nitro-3H-1,3-benzoxazol-2-on SMIL: C1=CC2=C(C=C1[N+](=O)[O-])OC(=O)N2

Pris og tilgængelighed
Tekniske data

MDL nummer	MFCD00463755
PubChem CID	78419
Molekylvægt (g/mol)	180.119
CAS	4694-91-1
Synonym	6-nitrobenzo d oxazol-2 3h-one,6-nitro-2-benzoxazolinone,2 3h-benzoxazolone, 6-nitro,6-nitrobenzoxazolinone,6-nitro benzoxazolinone,6-nitro-3h-benzooxazol-2-one,6-nitrobenzoxazol-2 3h-one,6-nitrobenzoxazolone,6-nitrobenzoxazole-2 3h-one,6-nitro-1,3-benzoxazol-2 3h-one
SMIL	C1=CC2=C(C=C1[N+](=O)[O-])OC(=O)N2
IUPAC navn	6-nitro-3H-1,3-benzoxazol-2-on
InChI nøgle	JGYJZHYTADCWIK-UHFFFAOYSA-N
Molekylær formel	C7H4N2O4

Antimon(III)isopropoxid, 99,9% (metalbasis)

CAS: 18770-47-3 Molekylær formel: C9H21O3Sb Molekylvægt (g/mol): 299.024 MDL nummer: MFCD00143623 InChI nøgle: HYPTXUAFIRUIRD-UHFFFAOYSA-N Synonym: antimony iii isopropoxide,antimony 3+ tripropan-2-olate,triisopropoxyantimony,acmc-209epx,antimony iii propan-2-olate,antimony 3+ ; propan-2-olate,2-propanol,antimony 3+ salt 9ci,antimony 3+ ion tris propan-2-olate,antimony 3+ tris propan-2-olate PubChem CID: 3034303 IUPAC navn: antimon(3+);propan-2-olat SMIL: CC(C)[O-].CC(C)[O-].CC(C)[O-].[Sb+3]

Pris og tilgængelighed
Tekniske data

MDL nummer	MFCD00143623
PubChem CID	3034303
Molekylvægt (g/mol)	299.024
CAS	18770-47-3
Synonym	antimony iii isopropoxide,antimony 3+ tripropan-2-olate,triisopropoxyantimony,acmc-209epx,antimony iii propan-2-olate,antimony 3+ ; propan-2-olate,2-propanol,antimony 3+ salt 9ci,antimony 3+ ion tris propan-2-olate,antimony 3+ tris propan-2-olate
SMIL	CC(C)[O-].CC(C)[O-].CC(C)[O-].[Sb+3]
IUPAC navn	antimon(3+);propan-2-olat
InChI nøgle	HYPTXUAFIRUIRD-UHFFFAOYSA-N
Molekylær formel	C9H21O3Sb

Jern(II)methoxid, 98%

CAS: 7245-21-8 Molekylær formel: C2H6FeO2 Molekylvægt (g/mol): 117.913 MDL nummer: MFCD00061474 InChI nøgle: VAPRHKOWFRYFTF-UHFFFAOYSA-N Synonym: iron ii methoxide,iron 2+ dimethoxide,methanol, iron 2+ salt,acmc-1bc40 PubChem CID: 14598007 IUPAC navn: jern(2+);methanolat SMIL: C[O-].C[O-].[Fe+2]

Pris og tilgængelighed
Tekniske data

MDL nummer	MFCD00061474
PubChem CID	14598007
Molekylvægt (g/mol)	117.913
CAS	7245-21-8
Synonym	iron ii methoxide,iron 2+ dimethoxide,methanol, iron 2+ salt,acmc-1bc40
SMIL	C[O-].C[O-].[Fe+2]
IUPAC navn	jern(2+);methanolat
InChI nøgle	VAPRHKOWFRYFTF-UHFFFAOYSA-N
Molekylær formel	C2H6FeO2

4-fluor-5-nitrobenzen-1,2-diamin, teknisk kvalitet, Thermo Scientific™

CAS: 113269-06-0 Molekylær formel: C6H6FN3O2 Molekylvægt (g/mol): 171.131 InChI nøgle: QZNALIMEKAACKP-UHFFFAOYSA-N PubChem CID: 3782733 IUPAC navn: 4-fluor-5-nitrobenzen-1,2-diamin SMIL: C1=C(C(=CC(=C1[N+](=O)[O-])F)N)N

Pris og tilgængelighed
Tekniske data

PubChem CID	3782733
Molekylvægt (g/mol)	171.131
CAS	113269-06-0
SMIL	C1=C(C(=CC(=C1[N+](=O)[O-])F)N)N
IUPAC navn	4-fluor-5-nitrobenzen-1,2-diamin
InChI nøgle	QZNALIMEKAACKP-UHFFFAOYSA-N
Molekylær formel	C6H6FN3O2

Tantal(V) ethoxid, 99,999% (metalbasis), Nb <100ppm

CAS: 6074-84-6 Molekylær formel: C10H25O5Ta Molekylvægt (g/mol): 406.25 MDL nummer: MFCD00049785 InChI nøgle: HSXKFDGTKKAEHL-UHFFFAOYSA-N Synonym: tantalum v ethoxide,tantalum 5+ ethanolate,tantalum ethoxide,tantalum 5+ pentaethanolate,ethanol, tantalum 5+ salt,pentaethoxytantalum v,ethanol, tantalum 5+ salt 5:1,tantalum ethylate,pentaethyl tantalate,tantalum pentaethoxide PubChem CID: 160806 IUPAC navn: ethanolat;tantal(5+) SMIL: CCO[Ta](OCC)(OCC)(OCC)OCC

Pris og tilgængelighed
Tekniske data

MDL nummer	MFCD00049785
PubChem CID	160806
Molekylvægt (g/mol)	406.25
CAS	6074-84-6
Synonym	tantalum v ethoxide,tantalum 5+ ethanolate,tantalum ethoxide,tantalum 5+ pentaethanolate,ethanol, tantalum 5+ salt,pentaethoxytantalum v,ethanol, tantalum 5+ salt 5:1,tantalum ethylate,pentaethyl tantalate,tantalum pentaethoxide
SMIL	CCO[Ta](OCC)(OCC)(OCC)OCC
IUPAC navn	ethanolat;tantal(5+)
InChI nøgle	HSXKFDGTKKAEHL-UHFFFAOYSA-N
Molekylær formel	C10H25O5Ta

4-Nitro-o-phenylendiamin, 98%

CAS: 99-56-9 Molekylær formel: C6H7N3O2 Molekylvægt (g/mol): 153.14 MDL nummer: MFCD00007724 InChI nøgle: RAUWPNXIALNKQM-UHFFFAOYSA-N Synonym: 4-nitro-o-phenylenediamine,1,2-diamino-4-nitrobenzene,4-nitro-1,2-phenylenediamine,2-amino-4-nitroaniline,3,4-diaminonitrobenzene,p-nitro-o-phenylenediamine,1,2-benzenediamine, 4-nitro,4-nitro-1,2-diaminobenzene,4-nitrophenylenediamine,4-nitro-1,2-benzenediamine PubChem CID: 5111791 ChEBI: CHEBI:67116 IUPAC navn: 4-nitrobenzen-1,2-diamin SMIL: NC1=CC=C(C=C1N)[N+]([O-])=O

Pris og tilgængelighed
Tekniske data

MDL nummer	MFCD00007724
PubChem CID	5111791
Molekylvægt (g/mol)	153.14
CAS	99-56-9
ChEBI	CHEBI:67116
Synonym	4-nitro-o-phenylenediamine,1,2-diamino-4-nitrobenzene,4-nitro-1,2-phenylenediamine,2-amino-4-nitroaniline,3,4-diaminonitrobenzene,p-nitro-o-phenylenediamine,1,2-benzenediamine, 4-nitro,4-nitro-1,2-diaminobenzene,4-nitrophenylenediamine,4-nitro-1,2-benzenediamine
SMIL	NC1=CC=C(C=C1N)[N+]([O-])=O
IUPAC navn	4-nitrobenzen-1,2-diamin
InChI nøgle	RAUWPNXIALNKQM-UHFFFAOYSA-N
Molekylær formel	C6H7N3O2

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Organiske zwitterioner

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