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CAS Number: 139194-79-9
(3-bromo-5-nitrophenyl)methanol

Structure

(3-bromo-5-nitrophenyl)methanol
Name: (3-bromo-5-nitrophenyl)methanol
Synonyms:
General Information
Product Number: 139194799

CAS Registry Number 139194-79-9
Name:
Benzenemethanol, 3-​bromo-​5-​nitro-
(3-Bromo-5-nitrophenyl)methanol
3-Bromo-5-nitrobenzyl alcohol

 

Chemical Formula: C7H6BrNO3
Exact Mass: 230.95
Molecular Weight: 232.03
m/z: 230.95 (100.0%), 232.95 (97.3%), 231.96 (7.8%), 233.95 (7.7%)

 

InChI:InChI=1S/C7H6BrNO3/c8-6-1-5(4-10)2-7(3-6)9(11)12/h1-3,10H,4H2

InChI Key:WIXGOPRKQQGTHO-UHFFFAOYSA-N

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

 

Thermal Properties Value Condition Note
Melting Point 89-90 °C Solv: ethanol (64-17-5) (1)IC
Melting Point 88 °C   (2)CAS

Specification

98%

References
  1. (1) Zhu, Huixiang; Nanjing Daxue Xuebao, Ziran Kexue 1991, V27(1), P93-100 CAPLUS
  2. (2) Reuter, Raphael; Chemistry - A European Journal 2011, V17(10), P2987-2995, S2987/1-S2987/18 CAPLUS
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