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Sulfanylbenzoesäuren und Derivate

Sulfanylbenzoesäuren und Derivate

Organische Verbindungen, die aus Benzoesäure mit einer Sulfanylgruppe bestehen; eine Sulfanylgruppe ist ein Schwefelatom, das über eine Einzelbindung mit einem Wasserstoffatom verbunden ist. Dazu gehören Verbindungen, die direkt aus Sulfanylbenzoesäure gewonnen werden.
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1 – 15 von 32 Ergebnisse
1

Thimerosal, Thermo Scientific Chemicals

CAS: 54-64-8 Summenformel: C9H9HgNaO2S Molekulargewicht (g/mol): 404.81 MDL-Nummer: MFCD00013062 InChI-Schlüssel: RTKIYNMVFMVABJ-UHFFFAOYSA-L Synonym: thimerosal,thiomersal,thiomersalate,mercurothiolate,sodium merthiolate,sodium ethylmercurithiosalicylate,merthiolate,thimerosalate,thimerosalum,thimersalate PubChem CID: 16684434 ChEBI: CHEBI:9546 SMILES: [Na+].CC[Hg]SC1=CC=CC=C1C([O-])=O

InChI-Schlüssel RTKIYNMVFMVABJ-UHFFFAOYSA-L
PubChem CID 16684434
CAS 54-64-8
ChEBI CHEBI:9546
MDL-Nummer MFCD00013062
Molekulargewicht (g/mol) 404.81
SMILES [Na+].CC[Hg]SC1=CC=CC=C1C([O-])=O
Synonym thimerosal,thiomersal,thiomersalate,mercurothiolate,sodium merthiolate,sodium ethylmercurithiosalicylate,merthiolate,thimerosalate,thimerosalum,thimersalate
Summenformel C9H9HgNaO2S
2

Methylthiosalicylat, 97 %, Thermo Scientific Chemicals

CAS: 4892-02-8 Summenformel: C8H8O2S Molekulargewicht (g/mol): 168.22 MDL-Nummer: MFCD00060678 InChI-Schlüssel: 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-Name: methyl-2-sulfanylbenzoat SMILES: COC(=O)C1=CC=CC=C1S

InChI-Schlüssel BAQGCWNPCFABAY-UHFFFAOYSA-N
IUPAC-Name methyl-2-sulfanylbenzoat
PubChem CID 21009
CAS 4892-02-8
MDL-Nummer MFCD00060678
Molekulargewicht (g/mol) 168.22
SMILES COC(=O)C1=CC=CC=C1S
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
Summenformel C8H8O2S
3

4-(Methylthio)benzoesäure, 97 %, Thermo Scientific Chemicals

CAS: 13205-48-6 Summenformel: C8H8O2S Molekulargewicht (g/mol): 168.21 MDL-Nummer: MFCD00002555 InChI-Schlüssel: 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-Name: 4-(methylsulfanyl)benzoic acid SMILES: CSC1=CC=C(C=C1)C(O)=O

InChI-Schlüssel KWHCPERWLHBLOT-UHFFFAOYSA-N
IUPAC-Name 4-(methylsulfanyl)benzoic acid
PubChem CID 83230
CAS 13205-48-6
MDL-Nummer MFCD00002555
Molekulargewicht (g/mol) 168.21
SMILES CSC1=CC=C(C=C1)C(O)=O
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
Summenformel C8H8O2S
4

3-(Trifluormethylthio)Benzoesäure, 97 %, Thermo Scientific Chemicals

CAS: 946-65-6 Summenformel: C8H4F3O2S Molekulargewicht (g/mol): 221.17 MDL-Nummer: MFCD00236337 InChI-Schlüssel: IVGAPIVNQABETQ-UHFFFAOYSA-M Synonym: 3-trifluoromethylthio benzoic acid,3-trifluoromethyl thio benzoic acid,3-trifluoromethyl sulfanyl benzoic acid,3-trifluoromethylsulfanyl benzoic acid,3-trifluoromethylsulfanyl-benzoic acid,benzoic acid, 3-trifluoromethyl thio,3-trifluoromethyl sulphanyl benzoic acid,3-trifluoromethylthio benzoicacid,3-carboxyphenyl trifluoromethyl sulphide PubChem CID: 688330 IUPAC-Name: 3-[(trifluoromethyl)sulfanyl]benzoate SMILES: [O-]C(=O)C1=CC=CC(SC(F)(F)F)=C1

InChI-Schlüssel IVGAPIVNQABETQ-UHFFFAOYSA-M
IUPAC-Name 3-[(trifluoromethyl)sulfanyl]benzoate
PubChem CID 688330
CAS 946-65-6
MDL-Nummer MFCD00236337
Molekulargewicht (g/mol) 221.17
SMILES [O-]C(=O)C1=CC=CC(SC(F)(F)F)=C1
Synonym 3-trifluoromethylthio benzoic acid,3-trifluoromethyl thio benzoic acid,3-trifluoromethyl sulfanyl benzoic acid,3-trifluoromethylsulfanyl benzoic acid,3-trifluoromethylsulfanyl-benzoic acid,benzoic acid, 3-trifluoromethyl thio,3-trifluoromethyl sulphanyl benzoic acid,3-trifluoromethylthio benzoicacid,3-carboxyphenyl trifluoromethyl sulphide
Summenformel C8H4F3O2S
5

4-Aminocephalosporansäure, 90 %, Thermo Scientific Chemicals

CAS: 1074-36-8 Summenformel: C7H6O2S Molekulargewicht (g/mol): 154.18 MDL-Nummer: MFCD00016617 InChI-Schlüssel: 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-Name: 4-sulfanylbenzoic acid SMILES: OC(=O)C1=CC=C(S)C=C1

InChI-Schlüssel LMJXSOYPAOSIPZ-UHFFFAOYSA-N
IUPAC-Name 4-sulfanylbenzoic acid
PubChem CID 95738
CAS 1074-36-8
MDL-Nummer MFCD00016617
Molekulargewicht (g/mol) 154.18
SMILES OC(=O)C1=CC=C(S)C=C1
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
Summenformel C7H6O2S
6

Methyl-2-(methylthio)-benzoesäure, 98 %, Thermo Scientific Chemicals

CAS: 3704-28-7 Summenformel: C9H10O2S Molekulargewicht (g/mol): 182.237 MDL-Nummer: MFCD00068039 InChI-Schlüssel: CPQDZXPLQXZJGF-UHFFFAOYSA-N PubChem CID: 279586 IUPAC-Name: methyl-2-methylsulfanylbenzoat SMILES: COC(=O)C1=CC=CC=C1SC

InChI-Schlüssel CPQDZXPLQXZJGF-UHFFFAOYSA-N
IUPAC-Name methyl-2-methylsulfanylbenzoat
PubChem CID 279586
CAS 3704-28-7
MDL-Nummer MFCD00068039
Molekulargewicht (g/mol) 182.237
SMILES COC(=O)C1=CC=CC=C1SC
Summenformel C9H10O2S
7

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

CAS: 4885-02-3 Summenformel: C2H4Cl2O Molekulargewicht (g/mol): 114.96 MDL-Nummer: MFCD00000828 InChI-Schlüssel: GRTGGSXWHGKRSB-UHFFFAOYSA-N SMILES: COC(Cl)Cl

InChI-Schlüssel GRTGGSXWHGKRSB-UHFFFAOYSA-N
CAS 4885-02-3
MDL-Nummer MFCD00000828
Molekulargewicht (g/mol) 114.96
SMILES COC(Cl)Cl
Summenformel C2H4Cl2O
9

4-(Pentafluorthio)Benzoylchlorid, 97 %, Thermo Scientific™

CAS: 197384-98-8 Summenformel: C7H4ClF5OS Molekulargewicht (g/mol): 266.61 MDL-Nummer: MFCD03788523 InChI-Schlüssel: NNFDYUZNKYWPGP-UHFFFAOYSA-N Synonym: 4-pentafluorosulfanyl benzoyl chloride,4-pentafluorothio benzoyl chloride,sulfur, 4-chlorocarbonyl phenyl pentafluoro-, oc-6-21-9ci,4-pentafluoro-??-sulfanyl benzoyl chloride,4-pentafluorosulfanylbenzoic chloride,4-pentafluorosulphanylbenzoyl chloride,4-pentafluorosulphanyl benzoyl chloride,4-chlorocarbonyl phenylsulphur pentafluoride,4-pentafluoro-$l^ 6-sulfanyl benzoyl chloride,4-pentafluoro-lambda6-sulfanyl benzoyl chloride PubChem CID: 2779215 IUPAC-Name: 4-(pentafluor-$l^{6}-sulfanyl)Benzoylchlorid SMILES: FS(F)(F)(F)(F)C1=CC=C(C=C1)C(Cl)=O

InChI-Schlüssel NNFDYUZNKYWPGP-UHFFFAOYSA-N
IUPAC-Name 4-(pentafluor-$l^{6}-sulfanyl)Benzoylchlorid
PubChem CID 2779215
CAS 197384-98-8
MDL-Nummer MFCD03788523
Molekulargewicht (g/mol) 266.61
SMILES FS(F)(F)(F)(F)C1=CC=C(C=C1)C(Cl)=O
Synonym 4-pentafluorosulfanyl benzoyl chloride,4-pentafluorothio benzoyl chloride,sulfur, 4-chlorocarbonyl phenyl pentafluoro-, oc-6-21-9ci,4-pentafluoro-??-sulfanyl benzoyl chloride,4-pentafluorosulfanylbenzoic chloride,4-pentafluorosulphanylbenzoyl chloride,4-pentafluorosulphanyl benzoyl chloride,4-chlorocarbonyl phenylsulphur pentafluoride,4-pentafluoro-$l^ 6-sulfanyl benzoyl chloride,4-pentafluoro-lambda6-sulfanyl benzoyl chloride
Summenformel C7H4ClF5OS
10

3-Methyl-5-(Pentafluorothio)Benzoesäure, 97 %, Thermo Scientific™

CAS: 1448317-68-7 Summenformel: C8H7F5O2S Molekulargewicht (g/mol): 262.194 MDL-Nummer: MFCD16652478 InChI-Schlüssel: DHRPCCNJMXXYMQ-UHFFFAOYSA-N Synonym: 3-methyl-5-pentafluorosulfur benzoic acid,3-methyl-5-pentafluoro-??-sulfanyl benzoic acid,3-methyl-5-pentafluorothio benzoic acid,3-methyl-5-pentafluoro-lambda6-sulphanyl benzoic acid PubChem CID: 66523589 IUPAC-Name: 3-methyl-5-(pentafluor-$l^{6}-sulfanyl)benzoesäure SMILES: CC1=CC(=CC(=C1)C(=O)O)S(F)(F)(F)(F)F

InChI-Schlüssel DHRPCCNJMXXYMQ-UHFFFAOYSA-N
IUPAC-Name 3-methyl-5-(pentafluor-$l^{6}-sulfanyl)benzoesäure
PubChem CID 66523589
CAS 1448317-68-7
MDL-Nummer MFCD16652478
Molekulargewicht (g/mol) 262.194
SMILES CC1=CC(=CC(=C1)C(=O)O)S(F)(F)(F)(F)F
Synonym 3-methyl-5-pentafluorosulfur benzoic acid,3-methyl-5-pentafluoro-??-sulfanyl benzoic acid,3-methyl-5-pentafluorothio benzoic acid,3-methyl-5-pentafluoro-lambda6-sulphanyl benzoic acid
Summenformel C8H7F5O2S
11

2-(Methylsulfinyl)Benzoesäure, 97 %, Thermo Scientific™

CAS: 19093-34-6 Summenformel: C8H8O3S Molekulargewicht (g/mol): 184.21 MDL-Nummer: MFCD01936003 InChI-Schlüssel: JVYFTEBQXOBPAB-UHFFFAOYNA-N Synonym: 2-methylsulfinyl benzoic acid,2-methylsulfinyl benzenecarboxylic acid,2-methanesulfinylbenzoic acid,o-methylsulfinyl benzoic acid,benzoic acid, o-methylsulfinyl,benzoic acid, 2-methylsulfinyl,acmc-20aomr,2-methanesulfinyl benzoic acid,o-carboxyphenyl methyl sulfoxide,methylsulfinylbenzenecarboxylicacid PubChem CID: 320058 IUPAC-Name: 2-methanesulfinylbenzoic acid SMILES: CS(=O)C1=CC=CC=C1C(O)=O

InChI-Schlüssel JVYFTEBQXOBPAB-UHFFFAOYNA-N
IUPAC-Name 2-methanesulfinylbenzoic acid
PubChem CID 320058
CAS 19093-34-6
MDL-Nummer MFCD01936003
Molekulargewicht (g/mol) 184.21
SMILES CS(=O)C1=CC=CC=C1C(O)=O
Synonym 2-methylsulfinyl benzoic acid,2-methylsulfinyl benzenecarboxylic acid,2-methanesulfinylbenzoic acid,o-methylsulfinyl benzoic acid,benzoic acid, o-methylsulfinyl,benzoic acid, 2-methylsulfinyl,acmc-20aomr,2-methanesulfinyl benzoic acid,o-carboxyphenyl methyl sulfoxide,methylsulfinylbenzenecarboxylicacid
Summenformel C8H8O3S
12

3-(Methylthio)benzoesäure, 97 %, Thermo Scientific Chemicals

CAS: 825-99-0 Summenformel: C8H8O2S Molekulargewicht (g/mol): 168.21 MDL-Nummer: MFCD00156993 InChI-Schlüssel: 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-Name: 3-methylsulfanylbenzoesäure SMILES: CSC1=CC=CC(=C1)C(=O)O

InChI-Schlüssel PZGADOOBMVLBJE-UHFFFAOYSA-N
IUPAC-Name 3-methylsulfanylbenzoesäure
PubChem CID 220329
CAS 825-99-0
MDL-Nummer MFCD00156993
Molekulargewicht (g/mol) 168.21
SMILES CSC1=CC=CC(=C1)C(=O)O
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
Summenformel C8H8O2S
13

Methylthiosalicylat, 97 %, Thermo Scientific Chemicals

CAS: 4892-02-8 MDL-Nummer: MFCD00060678

CAS 4892-02-8
MDL-Nummer MFCD00060678
14

3-Fluor-5-(pentafluorthio)-Benzoesäure, 97 %, Thermo Scientific™

CAS: 1448319-13-8 Summenformel: C7H4F6O2S Molekulargewicht (g/mol): 266.157 MDL-Nummer: MFCD16652421 InChI-Schlüssel: WQRFQFPUMUJGOL-UHFFFAOYSA-N Synonym: 3-fluoro-5-pentafluorosulfur benzoic acid,3-fluoro-5-pentafluoro-??-sulfanyl benzoic acid,3-fluoro-5-pentafluorothio benzoic acid,3-fluoro-5-pentafluoro-lambda6-sulphanyl benzoic acid PubChem CID: 66523461 IUPAC-Name: 3-fluor-5-(pentafluor-$l^{6}-sulfanyl)benzoesäure SMILES: C1=C(C=C(C=C1F)S(F)(F)(F)(F)F)C(=O)O

InChI-Schlüssel WQRFQFPUMUJGOL-UHFFFAOYSA-N
IUPAC-Name 3-fluor-5-(pentafluor-$l^{6}-sulfanyl)benzoesäure
PubChem CID 66523461
CAS 1448319-13-8
MDL-Nummer MFCD16652421
Molekulargewicht (g/mol) 266.157
SMILES C1=C(C=C(C=C1F)S(F)(F)(F)(F)F)C(=O)O
Synonym 3-fluoro-5-pentafluorosulfur benzoic acid,3-fluoro-5-pentafluoro-??-sulfanyl benzoic acid,3-fluoro-5-pentafluorothio benzoic acid,3-fluoro-5-pentafluoro-lambda6-sulphanyl benzoic acid
Summenformel C7H4F6O2S
15

3-(Pentafluorthio)benzoesäure, 97 %, Thermo Scientific™

CAS: 833-96-5 Summenformel: C7H5F5O2S Molekulargewicht (g/mol): 248.167 MDL-Nummer: MFCD03788519 InChI-Schlüssel: AKFDIYXSRGLRAB-UHFFFAOYSA-N Synonym: 3-pentafluorosulfanyl benzoic acid,3-pentafluorothio benzoic acid,3-sulfurpentafluorobenzoic acid,3-pentafluoro-??-sulfanyl benzoic acid,3-pentafluorosulfanylbenzoic acid,3-carboxyphenylsulphur pentafluoride,3-pentafluorosulphanyl benzoic acid,3-pentafluoro-lambda6-sulfanyl benzoic acid,3-pentafluoro-$l^ 6-sulfanyl benzoic acid,3-pentafluoro-lambda6-sulphanyl benzoic acid PubChem CID: 2779209 IUPAC-Name: 3-(pentafluor-$l^{6}-sulfanyl)benzoesäure SMILES: C1=CC(=CC(=C1)S(F)(F)(F)(F)F)C(=O)O

InChI-Schlüssel AKFDIYXSRGLRAB-UHFFFAOYSA-N
IUPAC-Name 3-(pentafluor-$l^{6}-sulfanyl)benzoesäure
PubChem CID 2779209
CAS 833-96-5
MDL-Nummer MFCD03788519
Molekulargewicht (g/mol) 248.167
SMILES C1=CC(=CC(=C1)S(F)(F)(F)(F)F)C(=O)O
Synonym 3-pentafluorosulfanyl benzoic acid,3-pentafluorothio benzoic acid,3-sulfurpentafluorobenzoic acid,3-pentafluoro-??-sulfanyl benzoic acid,3-pentafluorosulfanylbenzoic acid,3-carboxyphenylsulphur pentafluoride,3-pentafluorosulphanyl benzoic acid,3-pentafluoro-lambda6-sulfanyl benzoic acid,3-pentafluoro-$l^ 6-sulfanyl benzoic acid,3-pentafluoro-lambda6-sulphanyl benzoic acid
Summenformel C7H5F5O2S