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Structure

4-Nitroisophthalic acid

CAS
4315-09-7
Catalog Number
ACM4315097-1
Category
Other Products
Molecular Weight
211.13
Molecular Formula
C8H5NO6

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Specification

Synonyms
4-Nitrobenzene-1,3-Dicarboxylic Acid
IUPAC Name
4-nitrobenzene-1,3-dicarboxylic acid
Canonical SMILES
C1=CC(=C(C=C1C(=O)O)C(=O)O)[N+](=O)[O-]
InChI Key
OCJFXVHDIVAONP-UHFFFAOYSA-N
Boiling Point
492.9 ºC at 760 mmHg
Melting Point
258-259 ºC
Flash Point
222.5 ºC
Density
1.671g/cm³
Appearance
White powder
EC Number
610-110-6
Exact Mass
211.01200
H-Bond Acceptor
6
H-Bond Donor
2
Safety Description
26-36/37/39

Upstream Synthesis Route 1

  • 121-91-5
  • 618-88-2
  • 4315-09-7

Reference: [1] Recueil des Travaux Chimiques des Pays-Bas, 1908, vol. 27, p. 277
[2] Journal fuer Praktische Chemie (Leipzig), 1888, vol. <2> 38, p. 313

Upstream Synthesis Route 2

  • 121-91-5
  • 7697-37-2
  • 618-88-2
  • 4315-09-7

Reference: [1] Recueil des Travaux Chimiques des Pays-Bas, 1908, vol. 27, p. 277

Upstream Synthesis Route 3

  • 89-87-2
  • 4315-09-7

Reference: [1] Patent: US6407116, 2002, B1,

Upstream Synthesis Route 4

  • 89-87-2
  • 4315-09-7

Reference: [1]Patent: US6407116,2002,B1

Upstream Synthesis Route 5

  • 121-91-5
  • 618-88-2
  • 4315-09-7

Reference: [1]Recueil des Travaux Chimiques des Pays-Bas,1908,vol. 27,p. 277

Upstream Synthesis Route 6

  • 3113-72-2
  • 4315-09-7

Reference: [1]Patent: US2016/264532,2016,A1 .Location in patent: Paragraph 0041

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