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CAS Number: 39503-61-2
1-(5-bromo-2-hydroxy-4-methoxyphenyl)ethanone

Structure

 1-(5-bromo-2-hydroxy-4-methoxyphenyl)ethanone
Name: 1-(5-bromo-2-hydroxy-4-methoxyphenyl)ethanone
Synonyms:
General Information
Product Number: 39503612

CAS Registry Number 39503-61-2
Name:
Ethanone, 1-?(5-?bromo-?2-?hydroxy-?4-?methoxyphenyl)?-
Acetophenone, 5'-bromo-2'-hydroxy-4'-methoxy- (6CI)
1-(5-Bromo-2-hydroxy-4-methoxyphenyl)ethanone
5-Bromo-2-hydroxy-4-methoxyacetophenone
5'-Bromo-2'-hydroxy-4'-methoxyacetophenone

 

Chemical Formula: C9H9BrO3
Exact Mass: 243.97
Molecular Weight: 245.07
m/z: 243.97 (100.0%), 245.97 (97.3%), 244.98 (10.0%), 246.97 (9.5%), 245.98 (1.1%), 247.98 (1.0%)

 

InChI:InChI=1S/C9H9BrO3/c1-5(11)6-3-7(10)9(13-2)4-8(6)12/h3-4,12H,1-2H3

InChI Key:KFFNBIVASILHIH-UHFFFAOYSA-N

Canonical SMILES:CC(=O)C1=CC(=C(C=C1O)OC)Br

 

Thermal Properties Value Condition Note
Melting Point 171-172 °C   (1)CAS
Melting Point 170 °C   (2)CAS
Melting Point 160-170 °C   (3)CAS

Specification

98%
References
  1. (1) Feng, Sin-Teh; Huaxue Xuebao 1959, P277-88 CAPLUS
  2. (2) Kaneniwa, Nobuyoshi; Yakugaku Zasshi 1955, V75, P785-8 CAPLUS
  3. (3) Jadhav, G. V.; Journal of the Indian Chemical Society 1951, V28, P403-4 CAPLUS
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