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CAS Number: 40925-68-6
2-amino-4-bromophenol

Structure

 2-amino-4-bromophenol
Name: 2-amino-4-bromophenol
Synonyms:
General Information
Product Number: 40925686

CAS Registry Number 40925-68-6
Name:
Phenol, 2-?amino-?4-?bromo-
2-Amino-4-bromophenol
4-Bromo-2-aminophenol
NSC 523846

 

Chemical Formula: C6H6BrNO
Exact Mass: 186.96
Molecular Weight: 188.02
m/z: 186.96 (100.0%), 188.96 (97.3%), 189.96 (6.7%), 187.97 (6.6%)

 

InChI:InChI=1S/C6H6BrNO/c7-4-1-2-6(9)5(8)3-4/h1-3,9H,8H2

InChI Key:JHRIPENGTGSNPJ-UHFFFAOYSA-N

Canonical SMILES:C1=CC(=C(C=C1Br)N)O

 

Thermal Properties Value Condition Note
Melting Point 134-135 °C Solv: water (7732-18-5) (3)CAS
Melting Point 130-133 °C   (4)IC
Melting Point 130-132 °C   (1)CAS
Melting Point 122-123 °C   (5)CAS

Specification

98%
References
  1. (1) von Wantoch Rekowski, Margarete; Bioorganic & Medicinal Chemistry 2010, V18(3), P1288-1296 CAPLUS
  2. (3) Irving, H.; Journal of the Chemical Society 1957, P285-90 CAPLUS
  3. (4) Hanzlik, Robert P.; Journal of Organic Chemistry 1990, V55(9), P2736-42 CAPLUS
  4. (5) Sridharan, V.; Indian Journal of Chemistry, Section B: Organic Chemistry Including Medicinal Chemistry 2004, V43B(10), P2243-2244 CAPLUS
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