2-Nitroterephthalic acid

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NCATS

Details

Stereochemistry	ACHIRAL
Molecular Formula	C8H5NO6
Molecular Weight	211.1284
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 2-Nitroterephthalic acid

Structure Search

SMILES

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

InChI

InChIKey=QUMITRDILMWWBC-UHFFFAOYSA-N

InChI=1S/C8H5NO6/c10-7(11)4-1-2-5(8(12)13)6(3-4)9(14)15/h1-3H,(H,10,11)(H,12,13)

HIDE SMILES / InChI

Molecular Formula	C8H5NO6
Molecular Weight	211.1284
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 17:47:47 GMT 2025` Edited by `admin` on `Tue Apr 01 17:47:47 GMT 2025`
Record UNII	QGE3D3HH23
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

2-Nitroterephthalic acid

Systematic Name

English

NSC-75848

Preferred Name

English

2-Nitro-1,4-benzenedicarboxylic acid

Systematic Name

English

1,4-Benzenedicarboxylic acid, 2-nitro-

Systematic Name

English

Code System Code Type Description

CAS

610-29-7

Created by admin on Tue Apr 01 17:47:47 GMT 2025 , Edited by admin on Tue Apr 01 17:47:47 GMT 2025

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ECHA (EC/EINECS)

210-217-4

Created by admin on Tue Apr 01 17:47:47 GMT 2025 , Edited by admin on Tue Apr 01 17:47:47 GMT 2025

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FDA UNII

QGE3D3HH23

Created by admin on Tue Apr 01 17:47:47 GMT 2025 , Edited by admin on Tue Apr 01 17:47:47 GMT 2025

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PUBCHEM

69122

Created by admin on Tue Apr 01 17:47:47 GMT 2025 , Edited by admin on Tue Apr 01 17:47:47 GMT 2025

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NSC

75848

Created by admin on Tue Apr 01 17:47:47 GMT 2025 , Edited by admin on Tue Apr 01 17:47:47 GMT 2025

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EPA CompTox

DTXSID8060583

Created by admin on Tue Apr 01 17:47:47 GMT 2025 , Edited by admin on Tue Apr 01 17:47:47 GMT 2025

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