2,3,5,6-Tetrafluoro-4-mercaptobenzoic acid

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Details

Stereochemistry	ACHIRAL
Molecular Formula	C7H2F4O2S
Molecular Weight	226.148
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 2,3,5,6-Tetrafluoro-4-mercaptobenzoic acid

Structure Search

SMILES

OC(=O)C1=C(F)C(F)=C(S)C(F)=C1F

InChI

InChIKey=USFMEWZQIHKRDP-UHFFFAOYSA-N

InChI=1S/C7H2F4O2S/c8-2-1(7(12)13)3(9)5(11)6(14)4(2)10/h14H,(H,12,13)

HIDE SMILES / InChI

Molecular Formula	C7H2F4O2S
Molecular Weight	226.148
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 `Tue Apr 01 20:13:47 GMT 2025` Edited by `admin` on `Tue Apr 01 20:13:47 GMT 2025`
Record UNII	XHG3CU8QRS
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

2,3,5,6-Tetrafluoro-4-mercaptobenzoic acid

Systematic Name

English

NSC-168719

Preferred Name

English

4-Mercapto-2,3,5,6-tetrafluorobenzoic acid

Common Name

English

Benzoic acid, 2,3,5,6-tetrafluoro-4-mercapto-

Systematic Name

English

2,3,5,6-Tetrafluoro-4-sulfanylbenzoic acid

Systematic Name

English

Code System Code Type Description

PUBCHEM

297543

Created by admin on Tue Apr 01 20:13:47 GMT 2025 , Edited by admin on Tue Apr 01 20:13:47 GMT 2025

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FDA UNII

XHG3CU8QRS

Created by admin on Tue Apr 01 20:13:47 GMT 2025 , Edited by admin on Tue Apr 01 20:13:47 GMT 2025

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CAS

5211-44-9

Created by admin on Tue Apr 01 20:13:47 GMT 2025 , Edited by admin on Tue Apr 01 20:13:47 GMT 2025

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NSC

168719

Created by admin on Tue Apr 01 20:13:47 GMT 2025 , Edited by admin on Tue Apr 01 20:13:47 GMT 2025

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EPA CompTox

DTXSID60200120

Created by admin on Tue Apr 01 20:13:47 GMT 2025 , Edited by admin on Tue Apr 01 20:13:47 GMT 2025

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