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Details

Stereochemistry ACHIRAL
Molecular Formula C7H8S
Molecular Weight 124.203
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of BENZYL MERCAPTAN

SMILES

SCC1=CC=CC=C1

InChI

InChIKey=UENWRTRMUIOCKN-UHFFFAOYSA-N
InChI=1S/C7H8S/c8-6-7-4-2-1-3-5-7/h1-5,8H,6H2

HIDE SMILES / InChI

Approval Year

Unknown
139594
PubMed

PubMed

TitleDatePubMed
Volatile components in defensive spray of the hooded skunk, Mephitis macroura.
2002 Sep
Monomeric, oligomeric, and polymeric flavan-3-ol composition of wines and grapes from Vitis vinifera L. Cv. Graciano, Tempranillo, and Cabernet Sauvignon.
2003 Oct 22
Identification of potent odorants formed during the preparation of extruded potato snacks.
2005 Aug 10
Parallel solution-phase synthesis of a 2,6,8,9-tetrasubstituted purine library via a sulfur intermediate.
2005 Jul-Aug
The application of phenylmethanethiol and benzenethiol derivatives as odorless organosulfur reagents in the synthesis of thiosugars and thioglycosides.
2005 Oct 31
Carbosilane dendrimers bearing globotriaoses: syntheses of globotrioasyl derivative and introduction into carbosilane dendrimers.
2006 Aug
Control of optically active structure of thioether-phthalocyanine aggregates by chiral Pd(II)-BINAP complexes in toluene and at the toluene/water interface.
2006 Aug
Mononuclear to polynuclear transition induced by ligand coordination: synthesis, X-ray structure, and properties of mono-, di-, and polynuclear copper(II) complexes of pyridyl-containing azo ligands.
2006 Jan 23
Convenient synthesis of a sialylglycopeptide-thioester having an intact and homogeneous complex-type disialyl-oligosaccharide.
2006 Jul 24
A surprisingly stable S-nitrosothiol complex.
2006 Mar 1
Relaxation dynamics and transient behavior of small arenethiol passivated gold nanoparticles.
2006 Mar 30
Studies on the mechanism of action of prekinamycin, a member of the diazoparaquinone family of natural products: evidence for both sp2 radical and orthoquinonemethide intermediates.
2006 Sep 27
Quantitative structure-activity relationship study of benzylsulfanyl imidazoles as cytokine release inhibitors.
2007 Feb
Oligomeric proanthocyanidins from mangosteen pericarps.
2007 Sep 19
Preparation and electrochemical and optical properties of unsymmetrically substituted phthalocyanines with one or two trithiole rings and related symmetric derivatives.
2008 May 5
Production of functionalized polyhydroxyalkanoates by genetically modified Methylobacterium extorquens strains.
2010 Sep 16
Patents

Patents

03980633
5
04315031
1
04886835
5
05157119
1
05179121
1
05190928
1
05529976
1
05565473
2
05627182
4
05646143
7
05686460
1
05847146
1
06005103
4
06316388
1
06365588
2
06576675
1
07064139
1
07399759
4
07655664
28
07767665
3
07833939
1
07928091
1
07977364
1
08093231
1
08110585
8
08263656
1
JP2002514197A
2
JP2002538151A
2
JP2003089720A
1
JP3272357B2
2
JPH01299286A
1
JPH07179464A
1
JPH10860A
1
JPH11209776A
2
JPS06242974A
1
JPS5668665A
1
JPS62192415A
1
Name Type Language
BENZYL MERCAPTAN
FHFI   HSDB   USP-RS  
Systematic Name English
TOLUENE, ALPHA-MERCAPTO-
Systematic Name English
.ALPHA.-TOLYL MERCAPTAN
Systematic Name English
THIOBENZYL ALCOHOL
MI  
Common Name English
TOLUENE-.ALPHA.-THIOL
Systematic Name English
PHENYLMETHYL MERCAPTAN
Systematic Name English
BENZYL MERCAPTAN [FHFI]
Common Name English
THIOBENZYL ALCOHOL [MI]
Common Name English
ALPHA-MERCAPTOTOLUENE
Systematic Name English
METHANETHIOL, PHENYL-
Systematic Name English
NSC-41897
Code English
BENZYL MERCAPTAN [HSDB]
Common Name English
PHENYLMETHANETHIOL
Systematic Name English
BENZENEMETHANETHIOL
Systematic Name English
.ALPHA.-TOLUOLTHIOL
Systematic Name English
BENZYLHYDROSULFIDE
Systematic Name English
FEMA NO. 2147
Code English
.ALPHA.-TOLUENETHIOL
Systematic Name English
BENZYL MERCAPTAN [USP-RS]
Common Name English
Classification Tree Code System Code
CFR 21 CFR 172.515
Created by admin on Fri Dec 15 19:08:23 GMT 2023 , Edited by admin on Fri Dec 15 19:08:23 GMT 2023
JECFA EVALUATION BENZYL MERCAPTAN
Created by admin on Fri Dec 15 19:08:23 GMT 2023 , Edited by admin on Fri Dec 15 19:08:23 GMT 2023
Code System Code Type Description
PUBCHEM
7509
Created by admin on Fri Dec 15 19:08:23 GMT 2023 , Edited by admin on Fri Dec 15 19:08:23 GMT 2023
PRIMARY
FDA UNII
OS34A21OBZ
Created by admin on Fri Dec 15 19:08:23 GMT 2023 , Edited by admin on Fri Dec 15 19:08:23 GMT 2023
PRIMARY
WIKIPEDIA
BENZYL MERCAPTAN
Created by admin on Fri Dec 15 19:08:23 GMT 2023 , Edited by admin on Fri Dec 15 19:08:23 GMT 2023
PRIMARY
CAS
100-53-8
Created by admin on Fri Dec 15 19:08:23 GMT 2023 , Edited by admin on Fri Dec 15 19:08:23 GMT 2023
PRIMARY
NSC
41897
Created by admin on Fri Dec 15 19:08:23 GMT 2023 , Edited by admin on Fri Dec 15 19:08:23 GMT 2023
PRIMARY
EPA CompTox
DTXSID6026664
Created by admin on Fri Dec 15 19:08:23 GMT 2023 , Edited by admin on Fri Dec 15 19:08:23 GMT 2023
PRIMARY
MERCK INDEX
m10745
Created by admin on Fri Dec 15 19:08:23 GMT 2023 , Edited by admin on Fri Dec 15 19:08:23 GMT 2023
PRIMARY Merck Index
RS_ITEM_NUM
1062074
Created by admin on Fri Dec 15 19:08:23 GMT 2023 , Edited by admin on Fri Dec 15 19:08:23 GMT 2023
PRIMARY
CHEBI
137674
Created by admin on Fri Dec 15 19:08:23 GMT 2023 , Edited by admin on Fri Dec 15 19:08:23 GMT 2023
PRIMARY
JECFA MONOGRAPH
498
Created by admin on Fri Dec 15 19:08:23 GMT 2023 , Edited by admin on Fri Dec 15 19:08:23 GMT 2023
PRIMARY
ECHA (EC/EINECS)
202-862-5
Created by admin on Fri Dec 15 19:08:23 GMT 2023 , Edited by admin on Fri Dec 15 19:08:23 GMT 2023
PRIMARY
HSDB
2105
Created by admin on Fri Dec 15 19:08:23 GMT 2023 , Edited by admin on Fri Dec 15 19:08:23 GMT 2023
PRIMARY
SUBSTANCE RECORD
Structure of BENZYL MERCAPTAN
NIH
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