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CAS Number: 35674-27-2
4-iodo-3-nitrobenzoic acid

Structure

 4-iodo-3-nitrobenzoic acid
Name: 4-iodo-3-nitrobenzoic acid
Synonyms:
General Information
Product Number: 35674272

CAS Registry Number 35674-27-2
Name:
Benzoic acid, 4-?iodo-?3-?nitro-
4-Iodo-3-nitrobenzoic acid
3-Nitro-4-iodobenzoic acid

 

Chemical Formula: C7H4INO4
Exact Mass: 292.92
Molecular Weight: 293.02
m/z: 292.92 (100.0%), 293.92 (8.1%)

 

InChI:InChI=1S/C7H4INO4/c8-5-2-1-4(7(10)11)3-6(5)9(12)13/h1-3H,(H,10,11)

InChI Key:DNMTZLCNLAIKQC-UHFFFAOYSA-N

Canonical SMILES:C1=CC(=C(C=C1C(=O)O)[N+](=O)[O-])I

 

Thermal Properties Value Condition Note
Melting Point 205-206 °C   (4)CAS
Melting Point 205 °C   (5)CAS
Melting Point See full text   (2)CAS

Specification

98%
References
  1. (2) Monnereau, Cyrille; Tetrahedron 2005, V61(42), P10113-10121 CAPLUS
  2. (4) McRae, J. A.; Journal of Organic Chemistry 1954, V19, P1500-8 CAPLUS
  3. (5) Slater, S. N.; New Zealand Journal of Science and Technology, Section B: General Section 1941, V23B(No. 1), P15-16 CAPLUS
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