2,4-Dichloro-3,5-dinitrobenzoic acid

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NCATS

Details

Stereochemistry	ACHIRAL
Molecular Formula	C7H2Cl2N2O6
Molecular Weight	281.007
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 2,4-Dichloro-3,5-dinitrobenzoic acid

Structure Search

SMILES

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

InChI

InChIKey=OCJYCLPVZHBZRL-UHFFFAOYSA-N

InChI=1S/C7H2Cl2N2O6/c8-4-2(7(12)13)1-3(10(14)15)5(9)6(4)11(16)17/h1H,(H,12,13)

HIDE SMILES / InChI

Molecular Formula	C7H2Cl2N2O6
Molecular Weight	281.007
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 19:17:38 GMT 2025` Edited by `admin` on `Tue Apr 01 19:17:38 GMT 2025`
Record UNII	6TW78MTV6Q
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

NSC-76602

Preferred Name

English

2,4-Dichloro-3,5-dinitrobenzoic acid

Systematic Name

English

Benzoic acid, 2,4-dichloro-3,5-dinitro-

Systematic Name

English

Code System Code Type Description

FDA UNII

6TW78MTV6Q

Created by admin on Tue Apr 01 19:17:38 GMT 2025 , Edited by admin on Tue Apr 01 19:17:38 GMT 2025

PRIMARY

PUBCHEM

96497

Created by admin on Tue Apr 01 19:17:38 GMT 2025 , Edited by admin on Tue Apr 01 19:17:38 GMT 2025

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ECHA (EC/EINECS)

258-136-3

Created by admin on Tue Apr 01 19:17:38 GMT 2025 , Edited by admin on Tue Apr 01 19:17:38 GMT 2025

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CAS

52729-03-0

Created by admin on Tue Apr 01 19:17:38 GMT 2025 , Edited by admin on Tue Apr 01 19:17:38 GMT 2025

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NSC

76602

Created by admin on Tue Apr 01 19:17:38 GMT 2025 , Edited by admin on Tue Apr 01 19:17:38 GMT 2025

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EPA CompTox

DTXSID60200701

Created by admin on Tue Apr 01 19:17:38 GMT 2025 , Edited by admin on Tue Apr 01 19:17:38 GMT 2025

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