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Details

Stereochemistry ACHIRAL
Molecular Formula C10H12O2S
Molecular Weight 196.266
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 3-((4-METHYLPHENYL)THIO)PROPIONIC ACID

SMILES

CC1=CC=C(SCCC(O)=O)C=C1

InChI

InChIKey=ZRYGVBRPRKRFHJ-UHFFFAOYSA-N
InChI=1S/C10H12O2S/c1-8-2-4-9(5-3-8)13-7-6-10(11)12/h2-5H,6-7H2,1H3,(H,11,12)

HIDE SMILES / InChI

Molecular Formula C10H12O2S
Molecular Weight 196.266
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 13:12:00 GMT 2023
Edited
by admin
on Sat Dec 16 13:12:00 GMT 2023
Record UNII
BUC5LW7DYL
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
3-((4-METHYLPHENYL)THIO)PROPIONIC ACID
Systematic Name English
3-((4-METHYLPHENYL)SULFANYL)PROPANOIC ACID
Systematic Name English
PROPANOIC ACID, 3-((4-METHYLPHENYL)THIO)-
Systematic Name English
3-P-TOLYLSULFANYL-PROPIONIC ACID
Systematic Name English
NSC-64356
Code English
Code System Code Type Description
FDA UNII
BUC5LW7DYL
Created by admin on Sat Dec 16 13:12:00 GMT 2023 , Edited by admin on Sat Dec 16 13:12:00 GMT 2023
PRIMARY
ECHA (EC/EINECS)
237-311-8
Created by admin on Sat Dec 16 13:12:00 GMT 2023 , Edited by admin on Sat Dec 16 13:12:00 GMT 2023
PRIMARY
PUBCHEM
83694
Created by admin on Sat Dec 16 13:12:00 GMT 2023 , Edited by admin on Sat Dec 16 13:12:00 GMT 2023
PRIMARY
CAS
13739-35-0
Created by admin on Sat Dec 16 13:12:00 GMT 2023 , Edited by admin on Sat Dec 16 13:12:00 GMT 2023
PRIMARY
NSC
64356
Created by admin on Sat Dec 16 13:12:00 GMT 2023 , Edited by admin on Sat Dec 16 13:12:00 GMT 2023
PRIMARY
EPA CompTox
DTXSID20160170
Created by admin on Sat Dec 16 13:12:00 GMT 2023 , Edited by admin on Sat Dec 16 13:12:00 GMT 2023
PRIMARY