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CAS Number: 41295-65-2
4-(chloromethyl)-6-methyl-2H-chromen-2-one

Structure

 4-(chloromethyl)-6-methyl-2H-chromen-2-one
Name: 4-(chloromethyl)-6-methyl-2H-chromen-2-one
Synonyms:
General Information
Product Number: 41295652

CAS Registry Number 41295-65-2
Name:
2H-?1-?Benzopyran-?2-?one, 4-?(chloromethyl)?-?6-?methyl-
Coumarin, 4-(chloromethyl)-6-methyl- (3CI)
4-(Chloromethyl)-6-methylcoumarin

 

Chemical Formula: C11H9ClO2
Exact Mass: 208.03
Molecular Weight: 208.64
m/z: 208.03 (100.0%), 210.03 (32.4%), 209.03 (12.0%), 211.03 (3.9%)

 

InChI:InChI=1S/C11H9ClO2/c1-7-2-3-10-9(4-7)8(6-12)5-11(13)14-10/h2-5H,6H2,1H3

InChI Key:SPXMXBBTSABPSK-UHFFFAOYSA-N

Canonical SMILES:CC1=CC2=C(C=C1)OC(=O)C=C2CCl

 

Thermal Properties Value Condition Note
Melting Point 149 °C   (3)CAS
Melting Point 146-147 °C   (4)IC

Specification

98%
References
  1. (3) Dey, B. B.; Journal of the Indian Chemical Society 1934, V11, P635-50 CAPLUS
  2. (4) Joshi, S. D.; Indian Journal of Chemistry, Section B: Organic Chemistry Including Medicinal Chemistry 1982, V21B(5), P399-402 CAPLUS
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