(2,5-Difluorophenyl)acetonitrile

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NCATS

Details

Stereochemistry	ACHIRAL
Molecular Formula	C8H5F2N
Molecular Weight	153.1288
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of (2,5-Difluorophenyl)acetonitrile

Structure Search

SMILES

FC1=CC(CC#N)=C(F)C=C1

InChI

InChIKey=UIMMFRUOZOWROM-UHFFFAOYSA-N

InChI=1S/C8H5F2N/c9-7-1-2-8(10)6(5-7)3-4-11/h1-2,5H,3H2

HIDE SMILES / InChI

Molecular Formula	C8H5F2N
Molecular Weight	153.1288
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 20:20:19 GMT 2025` Edited by `admin` on `Tue Apr 01 20:20:19 GMT 2025`
Record UNII	T7BC2T9854
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

(2,5-Difluorophenyl)acetonitrile

Systematic Name

English

2,5-Difluorobenzeneacetonitrile

Preferred Name

English

Benzeneacetonitrile, 2,5-difluoro-

Systematic Name

English

Code System Code Type Description

PUBCHEM

592780

Created by admin on Tue Apr 01 20:20:19 GMT 2025 , Edited by admin on Tue Apr 01 20:20:19 GMT 2025

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FDA UNII

T7BC2T9854

Created by admin on Tue Apr 01 20:20:19 GMT 2025 , Edited by admin on Tue Apr 01 20:20:19 GMT 2025

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ECHA (EC/EINECS)

274-051-4

Created by admin on Tue Apr 01 20:20:19 GMT 2025 , Edited by admin on Tue Apr 01 20:20:19 GMT 2025

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CAS

69584-87-8

Created by admin on Tue Apr 01 20:20:19 GMT 2025 , Edited by admin on Tue Apr 01 20:20:19 GMT 2025

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EPA CompTox

DTXSID40219851

Created by admin on Tue Apr 01 20:20:19 GMT 2025 , Edited by admin on Tue Apr 01 20:20:19 GMT 2025

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