3-OXO-3-(P-(PHENYLTHIO)PHENYL)DITHIOPROPIONIC ACID

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NCATS

Details

Stereochemistry	ACHIRAL
Molecular Formula	C15H12OS3
Molecular Weight	304.45
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 3-OXO-3-(P-(PHENYLTHIO)PHENYL)DITHIOPROPIONIC ACID

Structure Search

SMILES

SC(=S)CC(=O)C1=CC=C(SC2=CC=CC=C2)C=C1

InChI

InChIKey=GAVCSUDWLMBAJW-UHFFFAOYSA-N

InChI=1S/C15H12OS3/c16-14(10-15(17)18)11-6-8-13(9-7-11)19-12-4-2-1-3-5-12/h1-9H,10H2,(H,17,18)

HIDE SMILES / InChI

Molecular Formula	C15H12OS3
Molecular Weight	304.45
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 12:26:15 GMT 2023` Edited by `admin` on `Sat Dec 16 12:26:15 GMT 2023`
Record UNII	WX9AZJ7W96
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

3-OXO-3-(P-(PHENYLTHIO)PHENYL)DITHIOPROPIONIC ACID

Common Name

English

.BETA.-OXO-4-(PHENYLTHIO)BENZENEPROPANE(DITHIOIC) ACID

Systematic Name

English

BENZENEPROPANE(DITHIOIC) ACID, .BETA.-OXO-4-(PHENYLTHIO)-

Systematic Name

English

Code System Code Type Description

CAS

41054-41-5

Created by admin on Sat Dec 16 12:26:15 GMT 2023 , Edited by admin on Sat Dec 16 12:26:15 GMT 2023

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FDA UNII

WX9AZJ7W96

Created by admin on Sat Dec 16 12:26:15 GMT 2023 , Edited by admin on Sat Dec 16 12:26:15 GMT 2023

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PUBCHEM

6451678

Created by admin on Sat Dec 16 12:26:15 GMT 2023 , Edited by admin on Sat Dec 16 12:26:15 GMT 2023

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ECHA (EC/EINECS)

255-195-7

Created by admin on Sat Dec 16 12:26:15 GMT 2023 , Edited by admin on Sat Dec 16 12:26:15 GMT 2023

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EPA CompTox

DTXSID30194022

Created by admin on Sat Dec 16 12:26:15 GMT 2023 , Edited by admin on Sat Dec 16 12:26:15 GMT 2023

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