METHYL 2,5-DICHLORO-3-NITROBENZOATE

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NCATS

Details

Stereochemistry	ACHIRAL
Molecular Formula	C8H5Cl2NO4
Molecular Weight	250.036
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of METHYL 2,5-DICHLORO-3-NITROBENZOATE

Structure Search

SMILES

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

InChI

InChIKey=BHIJMLGSGLWEIR-UHFFFAOYSA-N

InChI=1S/C8H5Cl2NO4/c1-15-8(12)5-2-4(9)3-6(7(5)10)11(13)14/h2-3H,1H3

HIDE SMILES / InChI

Molecular Formula	C8H5Cl2NO4
Molecular Weight	250.036
Charge	0
Count

Stereochemistry	ACHIRAL
Additional Stereochemistry	No
Defined Stereocenters	0 / 0
E/Z Centers	0
Optical Activity	NONE

Approval Year

Patents

Patents

Substance Class	Chemical Created by `admin` on `Mon Mar 31 21:45:51 GMT 2025` Edited by `admin` on `Mon Mar 31 21:45:51 GMT 2025`
Record UNII	J98OF12KZP
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

BENZOIC ACID, 2,5-DICHLORO-3-NITRO-, METHYL ESTER

Preferred Name

English

METHYL 2,5-DICHLORO-3-NITROBENZOATE

Systematic Name

English

METHYL 3-NITRO-2,5-DICHLOROBENZOATE

Systematic Name

English

Code System Code Type Description

EPA CompTox

DTXSID5067843

Created by admin on Mon Mar 31 21:45:51 GMT 2025 , Edited by admin on Mon Mar 31 21:45:51 GMT 2025

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PUBCHEM

36821

Created by admin on Mon Mar 31 21:45:51 GMT 2025 , Edited by admin on Mon Mar 31 21:45:51 GMT 2025

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ECHA (EC/EINECS)

252-001-2

Created by admin on Mon Mar 31 21:45:51 GMT 2025 , Edited by admin on Mon Mar 31 21:45:51 GMT 2025

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CAS

34408-25-8

Created by admin on Mon Mar 31 21:45:51 GMT 2025 , Edited by admin on Mon Mar 31 21:45:51 GMT 2025

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FDA UNII

J98OF12KZP

Created by admin on Mon Mar 31 21:45:51 GMT 2025 , Edited by admin on Mon Mar 31 21:45:51 GMT 2025

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HSDB

6164

Created by admin on Mon Mar 31 21:45:51 GMT 2025 , Edited by admin on Mon Mar 31 21:45:51 GMT 2025

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