5,7-Dichloro-4-methylbenzo[b]thiophen-3(2H)-one

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

National Institutes of Health Divider Arrow

NCATS

Details

Stereochemistry	ACHIRAL
Molecular Formula	C9H6Cl2OS
Molecular Weight	233.114
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 5,7-Dichloro-4-methylbenzo[b]thiophen-3(2H)-one

Structure Search

SMILES

CC1=C(Cl)C=C(Cl)C2=C1C(=O)CS2

InChI

InChIKey=PYRFUPKTUOWRGF-UHFFFAOYSA-N

InChI=1S/C9H6Cl2OS/c1-4-5(10)2-6(11)9-8(4)7(12)3-13-9/h2H,3H2,1H3

HIDE SMILES / InChI

Molecular Formula	C9H6Cl2OS
Molecular Weight	233.114
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 20:20:57 GMT 2023` Edited by `admin` on `Sat Dec 16 20:20:57 GMT 2023`
Record UNII	7WZ96F9HBX
Record Status	`Validated (UNII)`
Record Version

Download

Name

Type

Language

5,7-Dichloro-4-methylbenzo[b]thiophen-3(2H)-one

Systematic Name

English

5,7-Dichloro-4-methylbenzo[b]thiophene-3(2H)-one

Systematic Name

English

Benzo[b]thiophen-3(2H)-one, 5,7-dichloro-4-methyl-

Systematic Name

English

Code System Code Type Description

FDA UNII

7WZ96F9HBX

Created by admin on Sat Dec 16 20:20:57 GMT 2023 , Edited by admin on Sat Dec 16 20:20:57 GMT 2023

PRIMARY

EPA CompTox

DTXSID40207293

Created by admin on Sat Dec 16 20:20:57 GMT 2023 , Edited by admin on Sat Dec 16 20:20:57 GMT 2023

PRIMARY

CAS

5858-19-5

Created by admin on Sat Dec 16 20:20:57 GMT 2023 , Edited by admin on Sat Dec 16 20:20:57 GMT 2023

PRIMARY

ECHA (EC/EINECS)

227-487-4

Created by admin on Sat Dec 16 20:20:57 GMT 2023 , Edited by admin on Sat Dec 16 20:20:57 GMT 2023

PRIMARY

PUBCHEM

79966

Created by admin on Sat Dec 16 20:20:57 GMT 2023 , Edited by admin on Sat Dec 16 20:20:57 GMT 2023

PRIMARY