5-Bromo-2-chlorobenzotrifluoride

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NCATS

Details

Stereochemistry	ACHIRAL
Molecular Formula	C7H3BrClF3
Molecular Weight	259.451
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 5-Bromo-2-chlorobenzotrifluoride

Structure Search

SMILES

FC(F)(F)C1=C(Cl)C=CC(Br)=C1

InChI

InChIKey=XGOCKBMEZPNDPJ-UHFFFAOYSA-N

InChI=1S/C7H3BrClF3/c8-4-1-2-6(9)5(3-4)7(10,11)12/h1-3H

HIDE SMILES / InChI

Molecular Formula	C7H3BrClF3
Molecular Weight	259.451
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 `Sat Dec 16 12:13:58 GMT 2023` Edited by `admin` on `Sat Dec 16 12:13:58 GMT 2023`
Record UNII	RK6Y7PY8S9
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

5-Bromo-2-chlorobenzotrifluoride

Systematic Name

English

4-Bromo-2-chloro-α,α,α-trifluorotoluene

Systematic Name

English

4-Bromo-1-chloro-2-(trifluoromethyl)benzene

Systematic Name

English

Benzene, 4-bromo-1-chloro-2-(trifluoromethyl)-

Systematic Name

English

Code System Code Type Description

CAS

445-01-2

Created by admin on Sat Dec 16 12:13:58 GMT 2023 , Edited by admin on Sat Dec 16 12:13:58 GMT 2023

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EPA CompTox

DTXSID20196196

Created by admin on Sat Dec 16 12:13:58 GMT 2023 , Edited by admin on Sat Dec 16 12:13:58 GMT 2023

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ECHA (EC/EINECS)

207-149-2

Created by admin on Sat Dec 16 12:13:58 GMT 2023 , Edited by admin on Sat Dec 16 12:13:58 GMT 2023

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PUBCHEM

67959

Created by admin on Sat Dec 16 12:13:58 GMT 2023 , Edited by admin on Sat Dec 16 12:13:58 GMT 2023

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FDA UNII

RK6Y7PY8S9

Created by admin on Sat Dec 16 12:13:58 GMT 2023 , Edited by admin on Sat Dec 16 12:13:58 GMT 2023

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