2-(4-CHLOROPHENYL)-3-OXOBUTYRONITRILE

Details

Stereochemistry	RACEMIC
Molecular Formula	C10H8ClNO
Molecular Weight	193.63
Optical Activity	( + / - )
Defined Stereocenters	0 / 1
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 2-(4-CHLOROPHENYL)-3-OXOBUTYRONITRILE

Structure Search

SMILES

CC(=O)C(C#N)C1=CC=C(Cl)C=C1

InChI

InChIKey=IPBZEJZUAZXNOS-UHFFFAOYSA-N

InChI=1S/C10H8ClNO/c1-7(13)10(6-12)8-2-4-9(11)5-3-8/h2-5,10H,1H3

HIDE SMILES / InChI

Molecular Formula	C10H8ClNO
Molecular Weight	193.63
Charge	0
Count

Stereochemistry	RACEMIC
Additional Stereochemistry	No
Defined Stereocenters	0 / 1
E/Z Centers	0
Optical Activity	( + / - )

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 18:47:32 GMT 2023` Edited by `admin` on `Sat Dec 16 18:47:32 GMT 2023`
Record UNII	H823RV67E7
Record Status	`Validated (UNII)`
Record Version

Download

Name

Type

Language

2-(4-CHLOROPHENYL)-3-OXOBUTYRONITRILE

Systematic Name

English

Acetoacetonitrile, 2-(p-chlorophenyl)-

Systematic Name

English

p-Chlorophenylacetoacetonitrile

Systematic Name

English

α-Acetyl-4-chlorobenzeneacetonitrile

Systematic Name

English

2-(4-Chloro-phenyl)-3-oxo-butyronitrile

Systematic Name

English

Benzeneacetonitrile, α-acetyl-4-chloro-

Systematic Name

English

Code System Code Type Description

PUBCHEM

21280

Created by admin on Sat Dec 16 18:47:32 GMT 2023 , Edited by admin on Sat Dec 16 18:47:32 GMT 2023

PRIMARY

EPA CompTox

DTXSID90884139

Created by admin on Sat Dec 16 18:47:32 GMT 2023 , Edited by admin on Sat Dec 16 18:47:32 GMT 2023

PRIMARY

CAS

5219-07-8

Created by admin on Sat Dec 16 18:47:32 GMT 2023 , Edited by admin on Sat Dec 16 18:47:32 GMT 2023

PRIMARY

FDA UNII

H823RV67E7

Created by admin on Sat Dec 16 18:47:32 GMT 2023 , Edited by admin on Sat Dec 16 18:47:32 GMT 2023

PRIMARY