(PENTAFLUOROPHENYL)ACETIC ACID

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NCATS

Details

Stereochemistry	ACHIRAL
Molecular Formula	C8H3F5O2
Molecular Weight	226.1002
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of (PENTAFLUOROPHENYL)ACETIC ACID

Structure Search

SMILES

OC(=O)CC1=C(F)C(F)=C(F)C(F)=C1F

InChI

InChIKey=LGCODSNZJOVMHV-UHFFFAOYSA-N

InChI=1S/C8H3F5O2/c9-4-2(1-3(14)15)5(10)7(12)8(13)6(4)11/h1H2,(H,14,15)

HIDE SMILES / InChI

Molecular Formula	C8H3F5O2
Molecular Weight	226.1002
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 19:14:09 GMT 2025` Edited by `admin` on `Tue Apr 01 19:14:09 GMT 2025`
Record UNII	F2HFR5VJK7
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

2,3,4,5,6-PENTAFLUOROBENZENEACETIC ACID

Preferred Name

English

(PENTAFLUOROPHENYL)ACETIC ACID

Systematic Name

English

BENZENEACETIC ACID, 2,3,4,5,6-PENTAFLUORO-

Systematic Name

English

Code System Code Type Description

CAS

653-21-4

Created by admin on Tue Apr 01 19:14:09 GMT 2025 , Edited by admin on Tue Apr 01 19:14:09 GMT 2025

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EPA CompTox

DTXSID50215642

Created by admin on Tue Apr 01 19:14:09 GMT 2025 , Edited by admin on Tue Apr 01 19:14:09 GMT 2025

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ECHA (EC/EINECS)

211-497-0

Created by admin on Tue Apr 01 19:14:09 GMT 2025 , Edited by admin on Tue Apr 01 19:14:09 GMT 2025

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FDA UNII

F2HFR5VJK7

Created by admin on Tue Apr 01 19:14:09 GMT 2025 , Edited by admin on Tue Apr 01 19:14:09 GMT 2025

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PUBCHEM

69553

Created by admin on Tue Apr 01 19:14:09 GMT 2025 , Edited by admin on Tue Apr 01 19:14:09 GMT 2025

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