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CAS Number: 116632-23-6
3-bromo-5-nitrophenol

Structure

3-bromo-5-nitrophenol
Name: 3-bromo-5-nitrophenol
Synonyms:
General Information
Product Number: 116632236

CAS Registry Number 116632-23-6
Name:
Phenol, 3-​bromo-​5-​nitro-
3-Bromo-5-nitrophenol

 

Chemical Formula: C6H4BrNO3
Exact Mass: 216.94
Molecular Weight: 218.00
m/z: 216.94 (100.0%), 218.94 (98.1%), 217.94 (6.6%), 219.94 (6.5%)

 

InChI:InChI=1S/C6H4BrNO3/c7-4-1-5(8(10)11)3-6(9)2-4/h1-3,9H

InChI Key:VJQGLUHOAIZTNK-UHFFFAOYSA-N

Canonical SMILES:C1=C(C=C(C=C1O)Br)[N+](=O)[O-]

 

Thermal Properties Value Condition Note
Melting Point 145 °C   (3)CAS
Melting Point 145 °C   (4)CAS
Melting Point 142-143 °C   (5)CAS

Specification

98%

References
  1. (3) Blanksma, Jan. J.; Pr. K. Akad. Wetensch., Amsterdam 1907, V9, P278-80 CAPLUS
  2. (4) Blanksma, J. J.; Amsterdam. Rec. trav. chim. 1908, V27, P25-41 CAPLUS
  3. (5) Martynova, V. F.; Zhurnal Obshchei Khimii 1956, V26, P894-7 CAPLUS
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