3-THIOPHENETHIOL

U.S. Department of Health & Human Services Divider Arrow

National Institutes of Health Divider Arrow

NCATS

Details

Stereochemistry	ACHIRAL
Molecular Formula	C4H4S2
Molecular Weight	116.205
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 3-THIOPHENETHIOL

Structure Search

SMILES

SC1=CSC=C1

InChI

InChIKey=VSGXHZUTTFLSBC-UHFFFAOYSA-N

InChI=1S/C4H4S2/c5-4-1-2-6-3-4/h1-3,5H

HIDE SMILES / InChI

Molecular Formula	C4H4S2
Molecular Weight	116.205
Charge	0
Count

Stereochemistry	ACHIRAL
Additional Stereochemistry	No
Defined Stereocenters	0 / 0
E/Z Centers	0
Optical Activity	NONE

Approval Year

PubMed

PubMed

Title	Date	PubMed
Formation of aroma compounds from ribose and cysteine during the Maillard reaction.	2003 Apr 23	12696962
GC-olfactometric characterization of aroma volatiles from the thermal degradation of thiamin in model orange juice.	2003 May 7	12720398

Substance Class	Chemical Created by `admin` on `Fri Dec 15 18:59:42 GMT 2023` Edited by `admin` on `Fri Dec 15 18:59:42 GMT 2023`
Record UNII	2PG6284B35
Record Status	`Validated (UNII)`
Record Version

Download

Name

Type

Language

3-THIOPHENETHIOL

Systematic Name

English

3-THIENYL MERCAPTAN

Systematic Name

English

3-MERCAPTOTHIOPHENE

Systematic Name

English

Code System Code Type Description

CAS

7774-73-4

Created by admin on Fri Dec 15 18:59:42 GMT 2023 , Edited by admin on Fri Dec 15 18:59:42 GMT 2023

PRIMARY

ECHA (EC/EINECS)

231-880-6

Created by admin on Fri Dec 15 18:59:42 GMT 2023 , Edited by admin on Fri Dec 15 18:59:42 GMT 2023

PRIMARY

FDA UNII

2PG6284B35

Created by admin on Fri Dec 15 18:59:42 GMT 2023 , Edited by admin on Fri Dec 15 18:59:42 GMT 2023

PRIMARY

PUBCHEM

82202

Created by admin on Fri Dec 15 18:59:42 GMT 2023 , Edited by admin on Fri Dec 15 18:59:42 GMT 2023

PRIMARY

EPA CompTox

DTXSID6064799

Created by admin on Fri Dec 15 18:59:42 GMT 2023 , Edited by admin on Fri Dec 15 18:59:42 GMT 2023

PRIMARY