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CAS Number: 55580-00-2
7-methoxy-3,4-dihydrobenzo[b]oxepin-5(2H)-one

Structure

 7-methoxy-3,4-dihydrobenzo[b]oxepin-5(2H)-one
Name: 7-methoxy-3,4-dihydrobenzo[b]oxepin-5(2H)-one
Synonyms:
General Information
Product Number: 55580002

CAS Registry Number 55580-00-2
Name:
1-?Benzoxepin-?5(2H)?-?one, 3,?4-?dihydro-?7-?methoxy-
3,4-Dihydro-7-methoxy-1(2H)-benzoxepin-5-one
3,4-Dihydro-7-methoxy-1-benzoxepin-5(2H)-one

 

Chemical Formula: C11H12O3
Exact Mass: 192.08
Molecular Weight: 192.21
m/z: 192.08 (100.0%), 193.08 (12.1%)

 

InChI:InChI=1S/C11H12O3/c1-13-8-4-5-11-9(7-8)10(12)3-2-6-14-11/h4-5,7H,2-3,6H2,1H3

InChI Key:CZDQPKDUJDKJRF-UHFFFAOYSA-N

Canonical SMILES:COC1=CC2=C(C=C1)OCCCC2=O

 

Thermal Properties Value Condition Note
Boiling Point 100 °C Press: 0.5 Torr (1)IC

Specification

98%
References
  1. (1) Khanna, J. M.; Indian Journal of Chemistry, Section B: Organic Chemistry Including Medicinal Chemistry 1985, V24B(1), P71-7 CAPLUS
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