4-METHYLBENZOTRIFLUORIDE

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NCATS

Details

Stereochemistry	ACHIRAL
Molecular Formula	C8H7F3
Molecular Weight	160.1364
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 4-METHYLBENZOTRIFLUORIDE

Structure Search

SMILES

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

InChI

InChIKey=LRLRAYMYEXQKID-UHFFFAOYSA-N

InChI=1S/C8H7F3/c1-6-2-4-7(5-3-6)8(9,10)11/h2-5H,1H3

HIDE SMILES / InChI

Molecular Formula	C8H7F3
Molecular Weight	160.1364
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 19:25:34 GMT 2025` Edited by `admin` on `Tue Apr 01 19:25:34 GMT 2025`
Record UNII	JH7JBW374B
Record Status	`Validated (UNII)`
Record Version

Download

Name

Type

Language

4-METHYLBENZOTRIFLUORIDE

Common Name

English

ALPHA,ALPHA,ALPHA-TRIFLUORO-P-XYLENE

Preferred Name

English

P-METHYLBENZOTRIFLUORIDE

Common Name

English

P-XYLENE, .ALPHA.,.ALPHA.,.ALPHA.-TRIFLUORO-

Systematic Name

English

BENZENE, 1-METHYL-4-(TRIFLUOROMETHYL)-

Systematic Name

English

1-METHYL-4-(TRIFLUOROMETHYL)BENZENE

Systematic Name

English

Code System Code Type Description

EPA CompTox

DTXSID10210335

Created by admin on Tue Apr 01 19:25:34 GMT 2025 , Edited by admin on Tue Apr 01 19:25:34 GMT 2025

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ECHA (EC/EINECS)

228-124-2

Created by admin on Tue Apr 01 19:25:34 GMT 2025 , Edited by admin on Tue Apr 01 19:25:34 GMT 2025

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CAS

6140-17-6

Created by admin on Tue Apr 01 19:25:34 GMT 2025 , Edited by admin on Tue Apr 01 19:25:34 GMT 2025

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FDA UNII

JH7JBW374B

Created by admin on Tue Apr 01 19:25:34 GMT 2025 , Edited by admin on Tue Apr 01 19:25:34 GMT 2025

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PUBCHEM

80230

Created by admin on Tue Apr 01 19:25:34 GMT 2025 , Edited by admin on Tue Apr 01 19:25:34 GMT 2025

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