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CAS Number: 27684-84-0
5-bromo-2-nitrophenol

Structure

5-bromo-2-nitrophenol
Name: 5-bromo-2-nitrophenol
Synonyms:
General Information
Product Number: 27684840

CAS Registry Number: 27684-84-0

Name:

Phenol, 5-​bromo-​2-​nitro-
2-​Nitro-​5-​bromophenol; 3-​Bromo-​6-​nitrophenol; 5-​Bromo-​2-​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/c7-4-1-2-5(8(10)11)6(9)3-4/h1-3,9H
InChIKey: DTWHNSNSUBKGTC-UHFFFAOYSA-N
Canonical SMILES : C1=CC(=C(C=C1Br)O)[N+](=O)[O-]

 

Thermal Properties Value Condition Note
Melting Point 46-47 °C   (2)CAS
Melting Point 46-47 °C   (4)CAS
Melting Point 44-45 °C   (2)CAS
Melting Point 43-44 °C   (5)CAS
Melting Point 41.5-42.5 °C   (6)CAS
Melting Point 41.5-42.5 °C Solv: ethyl ether (60-29-7); hexane (110-54-3) (1)CAS
Melting Point See full text   (3)CAS

Specification

98%

References
  1. (1) Shen, Yuehai; Bioorganic & Medicinal Chemistry 2005, V13(16), P4960-4971 CAPLUS
  2. (2) Sathunuru, Ramadas; ARKIVOC (Gainesville, FL, United States) 2003, (15), P124-133 CAPLUS
  3. (3) Perez-Bolivar, Cesar; Chemistry - A European Journal 2011, V17(33), P9076-9082, S9076/1-S9076/21 CAPLUS
  4. (4) FR 1581400 1969 CAPLUS
  5. (5) Owari, Sakahiko; Yakugaku Zasshi 1951, V71, P246-9 CAPLUS
  6. (6) v. Auwers, K.; Forschritte der Chemie, Physik und physik. Chem. 1924, V18(No. 2), P37-77 CAPLUS
  7. (7) Gershon, H.; Monatshefte fuer Chemie 1995, V126(10), P1161-6 CAPLUS
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