METHYL 2-CHLORO-4-NITROBENZOATE

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NCATS

Details

Stereochemistry	ACHIRAL
Molecular Formula	C8H6ClNO4
Molecular Weight	215.591
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of METHYL 2-CHLORO-4-NITROBENZOATE

Structure Search

SMILES

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

InChI

InChIKey=PICNSXCJRMYANX-UHFFFAOYSA-N

InChI=1S/C8H6ClNO4/c1-14-8(11)6-3-2-5(10(12)13)4-7(6)9/h2-4H,1H3

HIDE SMILES / InChI

Molecular Formula	C8H6ClNO4
Molecular Weight	215.591
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 19:33:40 GMT 2025` Edited by `admin` on `Tue Apr 01 19:33:40 GMT 2025`
Record UNII	F9KQ5NY29Z
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

METHYL 2-CHLORO-4-NITROBENZOATE

Systematic Name

English

2-CHLORO-4-NITROBENZOIC ACID METHYL ESTER

Preferred Name

English

4-NITRO-2-CHLOROBENZOIC ACID METHYL ESTER

Common Name

English

BENZOIC ACID, 2-CHLORO-4-NITRO-, METHYL ESTER

Systematic Name

English

Code System Code Type Description

CAS

13324-11-3

Created by admin on Tue Apr 01 19:33:40 GMT 2025 , Edited by admin on Tue Apr 01 19:33:40 GMT 2025

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FDA UNII

F9KQ5NY29Z

Created by admin on Tue Apr 01 19:33:40 GMT 2025 , Edited by admin on Tue Apr 01 19:33:40 GMT 2025

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ECHA (EC/EINECS)

236-362-3

Created by admin on Tue Apr 01 19:33:40 GMT 2025 , Edited by admin on Tue Apr 01 19:33:40 GMT 2025

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EPA CompTox

DTXSID30158023

Created by admin on Tue Apr 01 19:33:40 GMT 2025 , Edited by admin on Tue Apr 01 19:33:40 GMT 2025

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PUBCHEM

83343

Created by admin on Tue Apr 01 19:33:40 GMT 2025 , Edited by admin on Tue Apr 01 19:33:40 GMT 2025

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