U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

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 P-THIOCRESOL

SMILES

CC1=CC=C(S)C=C1

InChI

InChIKey=WLHCBQAPPJAULW-UHFFFAOYSA-N
InChI=1S/C7H8S/c1-6-2-4-7(8)5-3-6/h2-5,8H,1H3

HIDE SMILES / InChI

Molecular Formula C7H8S
Molecular Weight 124.203
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

PubMed

PubMed

TitleDatePubMed
New paeonilactone-A adducts formed by anaerobic incubation of paeoniflorin with Lactobacillus brevis in the presence of arylthiols.
2001 Jul
Facile Cu(OTf)2-catalyzed preparation of per-O-acetylated hexopyranoses with stoichiometric acetic anhydride and sequential one-pot anomeric substitution to thioglycosides under solvent-free conditions.
2003 Oct 31
Surface-enhanced Raman spectroscopic-encoded beads for multiplex immunoassay.
2007 Mar-Apr
Screening of 397 chemicals and development of a quantitative structure--activity relationship model for androgen receptor antagonism.
2008 Apr
Silanization of Ag-deposited magnetite particles: an efficient route to fabricate magnetic nanoparticle-based Raman barcode materials.
2010 Jul
Patents
Substance Class Chemical
Created
by admin
on Fri Dec 15 19:43:04 GMT 2023
Edited
by admin
on Fri Dec 15 19:43:04 GMT 2023
Record UNII
6L2WW9XYZO
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
P-THIOCRESOL
MI  
Common Name English
P-THIOCRESOL [MI]
Common Name English
4-METHYLBENZENETHIOL
Systematic Name English
P-THIOLCRESOL
Common Name English
P-METHYLPHENYL MERCAPTAN
Common Name English
P-MERCAPTOTOLUENE
Common Name English
NSC-229565
Code English
4-METHYLPHENYL MERCAPTAN
Systematic Name English
P-METHYLPHENYLTHIOL
Common Name English
4-METHYLTHIOPHENOL
Systematic Name English
P-TOLUENETHIOL
Common Name English
P-METHYLBENZENTHIOL
Common Name English
1-MERCAPTO-4-METHYLBENZENE
Systematic Name English
P-TOLYLTHIOL
Common Name English
4-THIOCRESOL
HSDB  
Common Name English
4-METHYLPHENYLTHIOL
Common Name English
P-TOLYL MERCAPTAN
Common Name English
NSC-2227
Code English
4-TOLUENETHIOL
Systematic Name English
4-THIOCRESOL [HSDB]
Common Name English
P-METHYLBENZENETHIOL
Common Name English
4-MERCAPTOTOLUENE
Systematic Name English
P-METHYLTHIOPHENOL
Common Name English
4-METHYL-1-THIOPHENOL
Systematic Name English
Code System Code Type Description
MERCK INDEX
m10748
Created by admin on Fri Dec 15 19:43:04 GMT 2023 , Edited by admin on Fri Dec 15 19:43:04 GMT 2023
PRIMARY Merck Index
HSDB
2024
Created by admin on Fri Dec 15 19:43:04 GMT 2023 , Edited by admin on Fri Dec 15 19:43:04 GMT 2023
PRIMARY
MESH
C540257
Created by admin on Fri Dec 15 19:43:04 GMT 2023 , Edited by admin on Fri Dec 15 19:43:04 GMT 2023
PRIMARY
ECHA (EC/EINECS)
203-399-1
Created by admin on Fri Dec 15 19:43:04 GMT 2023 , Edited by admin on Fri Dec 15 19:43:04 GMT 2023
PRIMARY
PUBCHEM
7811
Created by admin on Fri Dec 15 19:43:04 GMT 2023 , Edited by admin on Fri Dec 15 19:43:04 GMT 2023
PRIMARY
EPA CompTox
DTXSID5048188
Created by admin on Fri Dec 15 19:43:04 GMT 2023 , Edited by admin on Fri Dec 15 19:43:04 GMT 2023
PRIMARY
NSC
2227
Created by admin on Fri Dec 15 19:43:04 GMT 2023 , Edited by admin on Fri Dec 15 19:43:04 GMT 2023
PRIMARY
FDA UNII
6L2WW9XYZO
Created by admin on Fri Dec 15 19:43:04 GMT 2023 , Edited by admin on Fri Dec 15 19:43:04 GMT 2023
PRIMARY
NSC
229565
Created by admin on Fri Dec 15 19:43:04 GMT 2023 , Edited by admin on Fri Dec 15 19:43:04 GMT 2023
PRIMARY
CAS
106-45-6
Created by admin on Fri Dec 15 19:43:04 GMT 2023 , Edited by admin on Fri Dec 15 19:43:04 GMT 2023
PRIMARY