3,5-BIS(TRIFLUOROMETHYL)PHENYLACETIC ACID

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NCATS

Details

Stereochemistry	ACHIRAL
Molecular Formula	C10H6F6O2
Molecular Weight	272.1439
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 3,5-BIS(TRIFLUOROMETHYL)PHENYLACETIC ACID

Structure Search

SMILES

OC(=O)CC1=CC(=CC(=C1)C(F)(F)F)C(F)(F)F

InChI

InChIKey=PAWSKKHEEYTXSA-UHFFFAOYSA-N

InChI=1S/C10H6F6O2/c11-9(12,13)6-1-5(3-8(17)18)2-7(4-6)10(14,15)16/h1-2,4H,3H2,(H,17,18)

HIDE SMILES / InChI

Molecular Formula	C10H6F6O2
Molecular Weight	272.1439
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 19:08:05 GMT 2025` Edited by `admin` on `Tue Apr 01 19:08:05 GMT 2025`
Record UNII	YW9DB76S84
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

3,5-BIS(TRIFLUOROMETHYL)PHENYLACETIC ACID

Systematic Name

English

3,5-BIS(TRIFLUOROMETHYL)BENZENEACETIC ACID

Preferred Name

English

BENZENEACETIC ACID, 3,5-BIS(TRIFLUOROMETHYL)-

Common Name

English

Code System Code Type Description

FDA UNII

YW9DB76S84

Created by admin on Tue Apr 01 19:08:05 GMT 2025 , Edited by admin on Tue Apr 01 19:08:05 GMT 2025

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EPA CompTox

DTXSID10234137

Created by admin on Tue Apr 01 19:08:05 GMT 2025 , Edited by admin on Tue Apr 01 19:08:05 GMT 2025

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ECHA (EC/EINECS)

285-295-6

Created by admin on Tue Apr 01 19:08:05 GMT 2025 , Edited by admin on Tue Apr 01 19:08:05 GMT 2025

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PUBCHEM

123587

Created by admin on Tue Apr 01 19:08:05 GMT 2025 , Edited by admin on Tue Apr 01 19:08:05 GMT 2025

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CAS

85068-33-3

Created by admin on Tue Apr 01 19:08:05 GMT 2025 , Edited by admin on Tue Apr 01 19:08:05 GMT 2025

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