1-(2-CHLOROETHYL)-2-(TRIFLUOROMETHYL)BENZENE

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NCATS

Details

Stereochemistry	ACHIRAL
Molecular Formula	C9H8ClF3
Molecular Weight	208.608
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 1-(2-CHLOROETHYL)-2-(TRIFLUOROMETHYL)BENZENE

Structure Search

SMILES

FC(F)(F)C1=CC=CC=C1CCCl

InChI

InChIKey=YCNNNSKOYTXTQL-UHFFFAOYSA-N

InChI=1S/C9H8ClF3/c10-6-5-7-3-1-2-4-8(7)9(11,12)13/h1-4H,5-6H2

HIDE SMILES / InChI

Molecular Formula	C9H8ClF3
Molecular Weight	208.608
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 17:40:47 GMT 2025` Edited by `admin` on `Tue Apr 01 17:40:47 GMT 2025`
Record UNII	S6AXJ58PRH
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

1-(2-CHLOROETHYL)-2-(TRIFLUOROMETHYL)BENZENE

Systematic Name

English

BENZENE, 1-(2-CHLOROETHYL)-2-(TRIFLUOROMETHYL)-

Preferred Name

English

Code System Code Type Description

PUBCHEM

594362

Created by admin on Tue Apr 01 17:40:47 GMT 2025 , Edited by admin on Tue Apr 01 17:40:47 GMT 2025

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CAS

94022-94-3

Created by admin on Tue Apr 01 17:40:47 GMT 2025 , Edited by admin on Tue Apr 01 17:40:47 GMT 2025

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EPA CompTox

DTXSID80240285

Created by admin on Tue Apr 01 17:40:47 GMT 2025 , Edited by admin on Tue Apr 01 17:40:47 GMT 2025

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ECHA (EC/EINECS)

301-588-4

Created by admin on Tue Apr 01 17:40:47 GMT 2025 , Edited by admin on Tue Apr 01 17:40:47 GMT 2025

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FDA UNII

S6AXJ58PRH

Created by admin on Tue Apr 01 17:40:47 GMT 2025 , Edited by admin on Tue Apr 01 17:40:47 GMT 2025

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