1-(4-FLUOROPHENYL)-4-OXOCYCLOHEXANECARBONITRILE

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National Institutes of Health Divider Arrow

NCATS

Details

Stereochemistry	ACHIRAL
Molecular Formula	C13H12FNO
Molecular Weight	217.2389
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 1-(4-FLUOROPHENYL)-4-OXOCYCLOHEXANECARBONITRILE

Structure Search

SMILES

FC1=CC=C(C=C1)C2(CCC(=O)CC2)C#N

InChI

InChIKey=FNWWTNNFZGBMEM-UHFFFAOYSA-N

InChI=1S/C13H12FNO/c14-11-3-1-10(2-4-11)13(9-15)7-5-12(16)6-8-13/h1-4H,5-8H2

HIDE SMILES / InChI

Approval Year

Name

Type

Language

LEVOCABASTINE HYDROCHLORIDE IMPURITY H [EP IMPURITY]

Preferred Name

English

1-(4-FLUOROPHENYL)-4-OXOCYCLOHEXANECARBONITRILE

Systematic Name

English

4-CYANO-4-(4-FLUOROPHENYL)CYCLOHEXAN-1-ONE

Systematic Name

English

CYCLOHEXANECARBONITRILE, 1-(4-FLUOROPHENYL)-4-OXO-

Systematic Name

English

4-CYANO-4-(4-FLUOROPHENYL)CYCLOHEXANONE

Systematic Name

English

Code System Code Type Description

CAS

56326-98-8

Created by admin on Tue Apr 01 18:53:46 GMT 2025 , Edited by admin on Tue Apr 01 18:53:46 GMT 2025

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FDA UNII

2K2RPS539D

Created by admin on Tue Apr 01 18:53:46 GMT 2025 , Edited by admin on Tue Apr 01 18:53:46 GMT 2025

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EPA CompTox

DTXSID3057777

Created by admin on Tue Apr 01 18:53:46 GMT 2025 , Edited by admin on Tue Apr 01 18:53:46 GMT 2025

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PUBCHEM

91805

Created by admin on Tue Apr 01 18:53:46 GMT 2025 , Edited by admin on Tue Apr 01 18:53:46 GMT 2025

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ECHA (EC/EINECS)

260-111-7

Created by admin on Tue Apr 01 18:53:46 GMT 2025 , Edited by admin on Tue Apr 01 18:53:46 GMT 2025

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SUBSTANCE RECORD


					2K2RPS539D

1-(4-FLUOROPHENYL)-4-OXOCYCLOHEXANECARBONITRILE