1-(Bromomethyl)-4-(trifluoromethyl)benzene

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NCATS

Details

Stereochemistry	ACHIRAL
Molecular Formula	C8H6BrF3
Molecular Weight	239.032
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 1-(Bromomethyl)-4-(trifluoromethyl)benzene

Structure Search

SMILES

FC(F)(F)C1=CC=C(CBr)C=C1

InChI

InChIKey=IKSNDOVDVVPSMA-UHFFFAOYSA-N

InChI=1S/C8H6BrF3/c9-5-6-1-3-7(4-2-6)8(10,11)12/h1-4H,5H2

HIDE SMILES / InChI

Molecular Formula	C8H6BrF3
Molecular Weight	239.032
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 19:36:53 GMT 2025` Edited by `admin` on `Tue Apr 01 19:36:53 GMT 2025`
Record UNII	T5YRU2P3EP
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

1-(Bromomethyl)-4-(trifluoromethyl)benzene

Systematic Name

English

Benzene, 1-(bromomethyl)-4-(trifluoromethyl)-

Preferred Name

English

Code System Code Type Description

ECHA (EC/EINECS)

206-947-8

Created by admin on Tue Apr 01 19:36:53 GMT 2025 , Edited by admin on Tue Apr 01 19:36:53 GMT 2025

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EPA CompTox

DTXSID30193196

Created by admin on Tue Apr 01 19:36:53 GMT 2025 , Edited by admin on Tue Apr 01 19:36:53 GMT 2025

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FDA UNII

T5YRU2P3EP

Created by admin on Tue Apr 01 19:36:53 GMT 2025 , Edited by admin on Tue Apr 01 19:36:53 GMT 2025

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CAS

402-49-3

Created by admin on Tue Apr 01 19:36:53 GMT 2025 , Edited by admin on Tue Apr 01 19:36:53 GMT 2025

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PUBCHEM

123062

Created by admin on Tue Apr 01 19:36:53 GMT 2025 , Edited by admin on Tue Apr 01 19:36:53 GMT 2025

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