4-Chloro-3,5-dinitrobenzonitrile

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NCATS

Details

Stereochemistry	ACHIRAL
Molecular Formula	C7H2ClN3O4
Molecular Weight	227.561
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 4-Chloro-3,5-dinitrobenzonitrile

Structure Search

SMILES

[O-][N+](=O)C1=CC(=CC(=C1Cl)[N+]([O-])=O)C#N

InChI

InChIKey=SCGDEDHSPCXGEC-UHFFFAOYSA-N

InChI=1S/C7H2ClN3O4/c8-7-5(10(12)13)1-4(3-9)2-6(7)11(14)15/h1-2H

HIDE SMILES / InChI

Molecular Formula	C7H2ClN3O4
Molecular Weight	227.561
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 17:37:42 GMT 2025` Edited by `admin` on `Tue Apr 01 17:37:42 GMT 2025`
Record UNII	AN6ZWE3GJE
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

4-Chloro-3,5-dinitrobenzonitrile

Systematic Name

English

NSC-74453

Preferred Name

English

Benzonitrile, 4-chloro-3,5-dinitro-

Systematic Name

English

Code System Code Type Description

EPA CompTox

DTXSID70172905

Created by admin on Tue Apr 01 17:37:42 GMT 2025 , Edited by admin on Tue Apr 01 17:37:42 GMT 2025

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PUBCHEM

16008

Created by admin on Tue Apr 01 17:37:42 GMT 2025 , Edited by admin on Tue Apr 01 17:37:42 GMT 2025

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FDA UNII

AN6ZWE3GJE

Created by admin on Tue Apr 01 17:37:42 GMT 2025 , Edited by admin on Tue Apr 01 17:37:42 GMT 2025

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CAS

1930-72-9

Created by admin on Tue Apr 01 17:37:42 GMT 2025 , Edited by admin on Tue Apr 01 17:37:42 GMT 2025

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ECHA (EC/EINECS)

217-686-4

Created by admin on Tue Apr 01 17:37:42 GMT 2025 , Edited by admin on Tue Apr 01 17:37:42 GMT 2025

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NSC

74453

Created by admin on Tue Apr 01 17:37:42 GMT 2025 , Edited by admin on Tue Apr 01 17:37:42 GMT 2025

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