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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 5-NITROISOPHTHALIC ACID

SMILES

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

InChI

InChIKey=NBDAHKQJXVLAID-UHFFFAOYSA-N
InChI=1S/C8H5NO6/c10-7(11)4-1-5(8(12)13)3-6(2-4)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

PubMed

PubMed

TitleDatePubMed
Poly[[mu2-aqua-bis[(1,10-phenanthroline)nickel(II)]]-di-mu2,mu4-5-nitro-1,3-benzenedicarboxylato].
2004 Nov
Triaqua-(2,2'-bipyridine)(5-nitro-isophthal-ato-κO)nickel(II) monohydrate.
2008 Dec 10
Subtle structural variation in copper metal-organic frameworks: syntheses, structures, magnetic properties and catalytic behaviour.
2008 Dec 21
The 1:1 proton-transfer compounds of 4-(phenyldiazenyl)aniline (aniline yellow) with 3-nitrophthalic, 4-nitrophthalic and 5-nitroisophthalic acids.
2008 Mar
catena-Poly[[aqua-(2,2'-bipyridyl)cobalt(II)]-μ-5-nitro-isophthalato].
2008 Nov 22
catena-Poly[[aqua-(2,2'-bipyridine-κN,N')copper(II)]-μ-5-nitro-isophthalato-κO,O:O].
2008 Nov 8
Triaqua-(2,2'-bipyridine-κN,N')(5-nitro-isophthalato-κO)zinc(II) monohydrate.
2008 Nov 8
(E)-5,5'-(Diazene-1,2-di-yl)diisophthalic acid N,N-dimethyl-formamide disolvate.
2008 Oct 25
Poly[di-μ(2)-acetato-diaquabis(2,2'-bi-pyridine)bis(μ(3)-5-nitroisophthalato)tricobalt(II)].
2009 Apr 10
catena-Poly[[bis-(3-carb-oxy-5-nitro-benzoato-κO)copper(II)]-μ-1,3-di-4-pyridylpropane-κN:N'].
2009 Aug 19
Poly[[diaqua-(3-carb-oxy-5-nitro-ben-zo-ato)(μ-5-nitro-benzene-1,3-dicarboxyl-ato)neodymium(III)] 2.5-hydrate].
2009 Aug 22
Poly[aqua-[μ(2)-cis-1,2-bis-(4-pyrid-yl)ethyl-ene-κN:N'](μ(2)-5-nitro-isophthalato-κO:O',O'')nickel(II)].
2009 Dec 19
Methyl 3-carboxy-5-nitrobenzoate.
2009 Jan 17
Poly[bis-(μ(3)-5-nitro-isophthalato)bis-(1,10-phenanthroline)dimanganese(II)].
2009 Mar 19
Triaqua-(2,2'-bipyridine N,N'-dioxide-κO,O')(5-nitro-benzene-1,3-dicarboxyl-ato-κO)zinc(II).
2009 May 20
Nanoporous lanthanide-carboxylate frameworks based on 5-nitroisophthalic acid.
2010 Feb 14
The subtle balance of weak supramolecular interactions: The hierarchy of halogen and hydrogen bonds in haloanilinium and halopyridinium salts.
2010 Jan 15
Bis[diamminesilver(I)] 5-nitro-iso-phthalate monohydrate.
2010 Mar 13
Bis(4-carboxy-piperidinium) 5-nitro-isophthalate.
2010 May 19
catena-Poly[(μ(2)-3-carb-oxy-5-nitro-benzoato)(μ(3)-5-nitro-benzene-1,3-dicarboxyl-ato)(1,10-phenanthroline)gadolinium(III)].
2010 Sep 8
Poly[[tris-(N,N-dimethyl-formamide)(μ(4)-5-nitro-isophthalato)(μ(3)-5-nitro-isophthalato)dicobalt(II)] N,N-dimethyl-formamide monosolvate].
2010 Sep 8
Patents
Substance Class Chemical
Created
by admin
on Fri Dec 15 16:44:57 UTC 2023
Edited
by admin
on Fri Dec 15 16:44:57 UTC 2023
Record UNII
G7RZ7LC76U
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
5-NITROISOPHTHALIC ACID
Systematic Name English
5-NITRO-1,3-BENZENEDICARBOXYLIC ACID
Systematic Name English
GLYCOPYRRONIUM BROMIDE IMPURITY O [EP IMPURITY]
Common Name English
GLYCOPYRROLATE RELATED COMPOUND A [USP-RS]
Common Name English
ISOPHTHALIC ACID, 5-NITRO-
Common Name English
GLYCOPYRROLATE RELATED COMPOUND A [USP IMPURITY]
Common Name English
1-NITROBENZENE-3,5-DICARBOXYLIC ACID
Systematic Name English
GLYCOPYRROLATE RELATED COMPOUND A
USP   USP-RS  
Common Name English
NSC-66545
Code English
1,3-BENZENEDICARBOXYLIC ACID, 5-NITRO-
Common Name English
5-NITROBENZENE-1,3-DICARBOXYLIC ACID
Systematic Name English
5-NITRO-M-PHTHALIC ACID
Common Name English
Code System Code Type Description
EPA CompTox
DTXSID7041540
Created by admin on Fri Dec 15 16:44:58 UTC 2023 , Edited by admin on Fri Dec 15 16:44:58 UTC 2023
PRIMARY
NSC
66545
Created by admin on Fri Dec 15 16:44:58 UTC 2023 , Edited by admin on Fri Dec 15 16:44:58 UTC 2023
PRIMARY
PUBCHEM
12069
Created by admin on Fri Dec 15 16:44:58 UTC 2023 , Edited by admin on Fri Dec 15 16:44:58 UTC 2023
PRIMARY
RS_ITEM_NUM
1296029
Created by admin on Fri Dec 15 16:44:58 UTC 2023 , Edited by admin on Fri Dec 15 16:44:58 UTC 2023
PRIMARY
ECHA (EC/EINECS)
210-568-3
Created by admin on Fri Dec 15 16:44:58 UTC 2023 , Edited by admin on Fri Dec 15 16:44:58 UTC 2023
PRIMARY
CAS
618-88-2
Created by admin on Fri Dec 15 16:44:58 UTC 2023 , Edited by admin on Fri Dec 15 16:44:58 UTC 2023
PRIMARY
FDA UNII
G7RZ7LC76U
Created by admin on Fri Dec 15 16:44:58 UTC 2023 , Edited by admin on Fri Dec 15 16:44:58 UTC 2023
PRIMARY
Related Record Type Details
PARENT -> IMPURITY
CHROMATOGRAPHIC PURITY (HPLC/UV)
USP