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Sulfanylbenzoesyrer og derivater

Organiske forbindelser, der består af benzoesyre med en sulfanylgruppesubstitution; en sulfanylgruppe er et svovlatom bundet til et hydrogenatom via en enkeltbinding. Omfatter forbindelser, der er direkte afledt af sulfanylbenzoesyre.

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1

2-(Methylthio)benzoic acid, 98+%

CAS: 3724-10-5 MDL nummer: MFCD00029934 ChEBI: CHEBI:4657

MDL nummer MFCD00029934
CAS 3724-10-5
ChEBI CHEBI:4657
2

Methyl 2-(methylthio)benzoate, 98%

CAS: 3704-28-7 Molekylær formel: C9H10O2S Molekylvægt (g/mol): 182.237 MDL nummer: MFCD00068039 InChI nøgle: CPQDZXPLQXZJGF-UHFFFAOYSA-N PubChem CID: 279586 IUPAC navn: methyl-2-methylsulfanylbenzoat SMIL: COC(=O)C1=CC=CC=C1SC

MDL nummer MFCD00068039
PubChem CID 279586
Molekylvægt (g/mol) 182.237
CAS 3704-28-7
SMIL COC(=O)C1=CC=CC=C1SC
IUPAC navn methyl-2-methylsulfanylbenzoat
InChI nøgle CPQDZXPLQXZJGF-UHFFFAOYSA-N
Molekylær formel C9H10O2S
3

3-(Methylthio)benzoic acid, 97%

CAS: 825-99-0 Molekylær formel: C8H8O2S Molekylvægt (g/mol): 168.21 MDL nummer: MFCD00156993 InChI nøgle: PZGADOOBMVLBJE-UHFFFAOYSA-N Synonym: 3-methylthio benzoic acid,3-methylsulfanyl benzoic acid,benzoic acid, 3-methylthio,benzoic acid, m-methylthio,3-mercaptobenzoic acid s-methyl ether,3-methylsulfanyl-benzoic acid,3-carboxythioanisole,pubchem10679 PubChem CID: 220329 IUPAC navn: 3-methylsulfanylbenzoesyre SMIL: CSC1=CC=CC(=C1)C(=O)O

MDL nummer MFCD00156993
PubChem CID 220329
Molekylvægt (g/mol) 168.21
CAS 825-99-0
Synonym 3-methylthio benzoic acid,3-methylsulfanyl benzoic acid,benzoic acid, 3-methylthio,benzoic acid, m-methylthio,3-mercaptobenzoic acid s-methyl ether,3-methylsulfanyl-benzoic acid,3-carboxythioanisole,pubchem10679
SMIL CSC1=CC=CC(=C1)C(=O)O
IUPAC navn 3-methylsulfanylbenzoesyre
InChI nøgle PZGADOOBMVLBJE-UHFFFAOYSA-N
Molekylær formel C8H8O2S
4

4-(methylthio)benzoesyre, 97 %, Thermo Scientific Chemicals

CAS: 13205-48-6 Molekylær formel: C8H8O2S Molekylvægt (g/mol): 168.21 MDL nummer: MFCD00002555 InChI nøgle: KWHCPERWLHBLOT-UHFFFAOYSA-N Synonym: 4-methylthio benzoic acid,4-methylsulfanyl benzoic acid,benzoic acid, 4-methylthio,p-methylthio benzoic acid,p-methiobenzoic acid,benzoic acid, p-methylthio,4-methylthiobenzoicacid,pubchem10665,acmc-1bqaa PubChem CID: 83230 IUPAC navn: 4-methylsulfanylbenzoesyre SMIL: CSC1=CC=C(C=C1)C(O)=O

MDL nummer MFCD00002555
PubChem CID 83230
Molekylvægt (g/mol) 168.21
CAS 13205-48-6
Synonym 4-methylthio benzoic acid,4-methylsulfanyl benzoic acid,benzoic acid, 4-methylthio,p-methylthio benzoic acid,p-methiobenzoic acid,benzoic acid, p-methylthio,4-methylthiobenzoicacid,pubchem10665,acmc-1bqaa
SMIL CSC1=CC=C(C=C1)C(O)=O
IUPAC navn 4-methylsulfanylbenzoesyre
InChI nøgle KWHCPERWLHBLOT-UHFFFAOYSA-N
Molekylær formel C8H8O2S
5

Methylthiosalicylat, 97 %, Thermo Scientific Chemicals

CAS: 4892-02-8 MDL nummer: MFCD00060678

MDL nummer MFCD00060678
CAS 4892-02-8
6

4-Mercaptobenzoesyre, 90 %, Thermo Scientific Chemicals

CAS: 1074-36-8 Molekylær formel: C7H6O2S Molekylvægt (g/mol): 154.18 MDL nummer: MFCD00016617 InChI nøgle: LMJXSOYPAOSIPZ-UHFFFAOYSA-N Synonym: 4-mercaptobenzoic acid,4-mercaptobenzoate,benzoic acid, 4-mercapto,4-mercapto-benzoic acid,4-mercapto benzoic acid,4-thiobenzoic acid,p-mercaptobenzoic acid,benzoic acid, p-mercapto,para-mercaptobenzoate,paracarboxythiophenol PubChem CID: 95738 IUPAC navn: 4-sulfanylbenzoesyre SMIL: OC(=O)C1=CC=C(S)C=C1

MDL nummer MFCD00016617
PubChem CID 95738
Molekylvægt (g/mol) 154.18
CAS 1074-36-8
Synonym 4-mercaptobenzoic acid,4-mercaptobenzoate,benzoic acid, 4-mercapto,4-mercapto-benzoic acid,4-mercapto benzoic acid,4-thiobenzoic acid,p-mercaptobenzoic acid,benzoic acid, p-mercapto,para-mercaptobenzoate,paracarboxythiophenol
SMIL OC(=O)C1=CC=C(S)C=C1
IUPAC navn 4-sulfanylbenzoesyre
InChI nøgle LMJXSOYPAOSIPZ-UHFFFAOYSA-N
Molekylær formel C7H6O2S
7
Kampagner er tilgængelige

1,1-dichlordimethylether, 97 %, Thermo Scientific Chemicals

CAS: 4885-02-3 Molekylær formel: C2H4Cl2O Molekylvægt (g/mol): 114.96 MDL nummer: MFCD00000828 InChI nøgle: GRTGGSXWHGKRSB-UHFFFAOYSA-N SMIL: COC(Cl)Cl

MDL nummer MFCD00000828
Molekylvægt (g/mol) 114.96
CAS 4885-02-3
SMIL COC(Cl)Cl
InChI nøgle GRTGGSXWHGKRSB-UHFFFAOYSA-N
Molekylær formel C2H4Cl2O
8

Methylthiosalicylat, 97 %, Thermo Scientific Chemicals

CAS: 4892-02-8 Molekylær formel: C8H8O2S Molekylvægt (g/mol): 168.22 MDL nummer: MFCD00060678 InChI nøgle: BAQGCWNPCFABAY-UHFFFAOYSA-N Synonym: methyl thiosalicylate,methyl 2-mercaptobenzoate,methyl o-mercaptobenzoate,usaf ma-15,benzoic acid, 2-mercapto-, methyl ester,methyl-o-mercaptobenzoate,methyl-2-mercaptobenzoate,benzoic acid, o-mercapto-, methyl ester,2-methoxycarbonyl thiophenol,2-mercaptobenzoic acid methyl ester PubChem CID: 21009 IUPAC navn: methyl-2-sulfanylbenzoat SMIL: COC(=O)C1=CC=CC=C1S

MDL nummer MFCD00060678
PubChem CID 21009
Molekylvægt (g/mol) 168.22
CAS 4892-02-8
Synonym methyl thiosalicylate,methyl 2-mercaptobenzoate,methyl o-mercaptobenzoate,usaf ma-15,benzoic acid, 2-mercapto-, methyl ester,methyl-o-mercaptobenzoate,methyl-2-mercaptobenzoate,benzoic acid, o-mercapto-, methyl ester,2-methoxycarbonyl thiophenol,2-mercaptobenzoic acid methyl ester
SMIL COC(=O)C1=CC=CC=C1S
IUPAC navn methyl-2-sulfanylbenzoat
InChI nøgle BAQGCWNPCFABAY-UHFFFAOYSA-N
Molekylær formel C8H8O2S
9

3-(Pentafluorothio)benzamide, 97%, Thermo Scientific™

CAS: 1240257-83-3 Molekylær formel: C7H6F5NOS Molekylvægt (g/mol): 247.18 MDL nummer: MFCD16652410 InChI nøgle: YLMGGQIZDXTBKX-UHFFFAOYSA-N Synonym: 3-pentafluorosulfur benzamide,3-pentafluoro-??-sulfanyl benzamide,3-pentafluorothio benzamide PubChem CID: 66523450 SMIL: NC(=O)C1=CC(=CC=C1)S(F)(F)(F)(F)F

MDL nummer MFCD16652410
PubChem CID 66523450
Molekylvægt (g/mol) 247.18
CAS 1240257-83-3
Synonym 3-pentafluorosulfur benzamide,3-pentafluoro-??-sulfanyl benzamide,3-pentafluorothio benzamide
SMIL NC(=O)C1=CC(=CC=C1)S(F)(F)(F)(F)F
InChI nøgle YLMGGQIZDXTBKX-UHFFFAOYSA-N
Molekylær formel C7H6F5NOS
10

3-Fluoro-5-(pentafluorothio)benzamide, 97%, Thermo Scientific™

CAS: 1240256-88-5 Molekylær formel: C7H5F6NOS Molekylvægt (g/mol): 265.17 MDL nummer: MFCD16652428 InChI nøgle: HOLSCWIIFRPMDH-UHFFFAOYSA-N Synonym: 3-fluoro-5-pentafluorosulfur benzamide,3-fluoro-5-pentafluoro-??-sulfanyl benzamide,3-fluoro-5-pentafluorothio benzamide PubChem CID: 66523469 IUPAC navn: 3-fluoro-5-(pentafluoro-$l^{6}-sulfanyl)benzamide SMIL: NC(=O)C1=CC(F)=CC(=C1)S(F)(F)(F)(F)F

MDL nummer MFCD16652428
PubChem CID 66523469
Molekylvægt (g/mol) 265.17
CAS 1240256-88-5
Synonym 3-fluoro-5-pentafluorosulfur benzamide,3-fluoro-5-pentafluoro-??-sulfanyl benzamide,3-fluoro-5-pentafluorothio benzamide
SMIL NC(=O)C1=CC(F)=CC(=C1)S(F)(F)(F)(F)F
IUPAC navn 3-fluoro-5-(pentafluoro-$l^{6}-sulfanyl)benzamide
InChI nøgle HOLSCWIIFRPMDH-UHFFFAOYSA-N
Molekylær formel C7H5F6NOS
11

2-Chloro-5-(pentafluorothio)benzamide, 97%, Thermo Scientific™

CAS: 1431329-71-3 Molekylær formel: C7H5ClF5NOS Molekylvægt (g/mol): 281.625 MDL nummer: MFCD22988934 InChI nøgle: ISPQOXNUNOTXHB-UHFFFAOYSA-N Synonym: 2-chloro-5-pentafluorothio benzamide,2-chloro-5-pentafluorosulfur benzamide,2-chloro-5-pentafluoro-??-sulfanyl benzamide PubChem CID: 73995213 IUPAC navn: 2-chloro-5-(pentafluoro-$l^{6}-sulfanyl)benzamide SMIL: C1=CC(=C(C=C1S(F)(F)(F)(F)F)C(=O)N)Cl

MDL nummer MFCD22988934
PubChem CID 73995213
Molekylvægt (g/mol) 281.625
CAS 1431329-71-3
Synonym 2-chloro-5-pentafluorothio benzamide,2-chloro-5-pentafluorosulfur benzamide,2-chloro-5-pentafluoro-??-sulfanyl benzamide
SMIL C1=CC(=C(C=C1S(F)(F)(F)(F)F)C(=O)N)Cl
IUPAC navn 2-chloro-5-(pentafluoro-$l^{6}-sulfanyl)benzamide
InChI nøgle ISPQOXNUNOTXHB-UHFFFAOYSA-N
Molekylær formel C7H5ClF5NOS
12

3-Chloro-5-(pentafluorothio)benzamide, 97%, Thermo Scientific™

CAS: 1240257-35-5 Molekylær formel: C7H5ClF5NOS Molekylvægt (g/mol): 281.63 MDL nummer: MFCD16652452 InChI nøgle: SCYISRHUJQHNFD-UHFFFAOYSA-N Synonym: 3-chloro-5-pentafluorosulfur benzamide,3-chloro-5-pentafluoro-??-sulfanyl benzamide,3-chloro-5-pentafluorothio benzamide PubChem CID: 66523520 IUPAC navn: 3-chloro-5-(pentafluoro-$l^{6}-sulfanyl)benzamide SMIL: NC(=O)C1=CC(=CC(Cl)=C1)S(F)(F)(F)(F)F

MDL nummer MFCD16652452
PubChem CID 66523520
Molekylvægt (g/mol) 281.63
CAS 1240257-35-5
Synonym 3-chloro-5-pentafluorosulfur benzamide,3-chloro-5-pentafluoro-??-sulfanyl benzamide,3-chloro-5-pentafluorothio benzamide
SMIL NC(=O)C1=CC(=CC(Cl)=C1)S(F)(F)(F)(F)F
IUPAC navn 3-chloro-5-(pentafluoro-$l^{6}-sulfanyl)benzamide
InChI nøgle SCYISRHUJQHNFD-UHFFFAOYSA-N
Molekylær formel C7H5ClF5NOS
13

2-Fluoro-5-(pentafluorothio)benzoic acid, 97%, Thermo Scientific™

CAS: 1240257-15-1 Molekylær formel: C7H4F6O2S Molekylvægt (g/mol): 266.157 MDL nummer: MFCD16652494 InChI nøgle: HQONRARZDMQSRY-UHFFFAOYSA-N Synonym: 2-fluoro-5-pentafluoro-??-sulfanyl benzoic acid,2-fluoro-5-pentafluorothio benzoic acid,2-fluoro-5-pentafluorosulfur benzoic acid PubChem CID: 66523626 IUPAC navn: 2-fluoro-5-(pentafluoro-$l^{6}-sulfanyl)benzoic acid SMIL: C1=CC(=C(C=C1S(F)(F)(F)(F)F)C(=O)O)F

MDL nummer MFCD16652494
PubChem CID 66523626
Molekylvægt (g/mol) 266.157
CAS 1240257-15-1
Synonym 2-fluoro-5-pentafluoro-??-sulfanyl benzoic acid,2-fluoro-5-pentafluorothio benzoic acid,2-fluoro-5-pentafluorosulfur benzoic acid
SMIL C1=CC(=C(C=C1S(F)(F)(F)(F)F)C(=O)O)F
IUPAC navn 2-fluoro-5-(pentafluoro-$l^{6}-sulfanyl)benzoic acid
InChI nøgle HQONRARZDMQSRY-UHFFFAOYSA-N
Molekylær formel C7H4F6O2S
14

2-Chloro-5-(pentafluorothio)benzoic acid, 97%, Thermo Scientific™

CAS: 1431329-70-2 Molekylær formel: C7H4ClF5O2S Molekylvægt (g/mol): 282.609 MDL nummer: MFCD22988931 InChI nøgle: KNKMPGVWOPIPMH-UHFFFAOYSA-N Synonym: 2-chloro-5-pentafluorothio benzoic acid,2-chloro-5-pentafluorosulfur benzoic acid,2-chloro-5-pentafluoro-??-sulfanyl benzoic acid PubChem CID: 73995201 IUPAC navn: 2-chloro-5-(pentafluoro-$l^{6}-sulfanyl)benzoic acid SMIL: C1=CC(=C(C=C1S(F)(F)(F)(F)F)C(=O)O)Cl

MDL nummer MFCD22988931
PubChem CID 73995201
Molekylvægt (g/mol) 282.609
CAS 1431329-70-2
Synonym 2-chloro-5-pentafluorothio benzoic acid,2-chloro-5-pentafluorosulfur benzoic acid,2-chloro-5-pentafluoro-??-sulfanyl benzoic acid
SMIL C1=CC(=C(C=C1S(F)(F)(F)(F)F)C(=O)O)Cl
IUPAC navn 2-chloro-5-(pentafluoro-$l^{6}-sulfanyl)benzoic acid
InChI nøgle KNKMPGVWOPIPMH-UHFFFAOYSA-N
Molekylær formel C7H4ClF5O2S
15

2-Methyl-5-(pentafluorothio)benzoic acid, 97%, Thermo Scientific™

CAS: 623943-54-4 Molekylær formel: C8H7F5O2S Molekylvægt (g/mol): 262.194 MDL nummer: MFCD16652477 InChI nøgle: HSIPIUUYFOAFKK-UHFFFAOYSA-N Synonym: 2-methyl-5-pentafluorosulfur benzoic acid,2-methyl-5-pentafluoro-??-sulfanyl benzoic acid,2-methyl-5-pentafluorothio benzoic acid PubChem CID: 66523588 IUPAC navn: 2-methyl-5-(pentafluoro-$l^{6}-sulfanyl)benzoic acid SMIL: CC1=C(C=C(C=C1)S(F)(F)(F)(F)F)C(=O)O

MDL nummer MFCD16652477
PubChem CID 66523588
Molekylvægt (g/mol) 262.194
CAS 623943-54-4
Synonym 2-methyl-5-pentafluorosulfur benzoic acid,2-methyl-5-pentafluoro-??-sulfanyl benzoic acid,2-methyl-5-pentafluorothio benzoic acid
SMIL CC1=C(C=C(C=C1)S(F)(F)(F)(F)F)C(=O)O
IUPAC navn 2-methyl-5-(pentafluoro-$l^{6}-sulfanyl)benzoic acid
InChI nøgle HSIPIUUYFOAFKK-UHFFFAOYSA-N
Molekylær formel C8H7F5O2S