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CAS Number: 74128-84-0
2-bromo-1-iodo-3-methoxybenzene

Structure

2-bromo-1-iodo-3-methoxybenzene
Name: 2-bromo-1-iodo-3-methoxybenzene
Synonyms:
General Information
Product Number: 74128840

CAS Registry Number 74128-84-0
Name:
Benzene, 2-​bromo-​1-​iodo-​3-​methoxy-
2-Bromo-1-iodo-3-methoxybenzene

 

Chemical Formula: C7H6BrIO
Exact Mass: 311.86
Molecular Weight: 312.93
m/z: 311.86 (100.0%), 313.86 (97.3%), 312.87 (7.7%), 314.87 (7.5%)

 

InChI:InChI=1S/C15H12BrNO/c1-2-17-14-5-3-10(9-18)7-12(14)13-8-11(16)4-6-15(13)17/h3-9H,2H2,1H3

InChI Key:AHDFNBLZEFXYOG-UHFFFAOYSA-N

Canonical SMILES:CCN1C2=C(C=C(C=C2)C=O)C3=C1C=CC(=C3)Br

 

Thermal Properties Value Condition Note
Melting Point 46-47 °C Solv: ethanol (64-17-5) (1)CAS
Melting Point 43-45 °C   (2)CAS

Specification

98%

References
  1. (1) Jensen, Thomas; Angewandte Chemie, International Edition 2008, V47(5), P888-890 CAPLUS
  2. (2) Tadd, Andrew C.; Chemical Communications (Cambridge, United Kingdom) 2009, (44), P6744-6746 CAPLUS
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