7-Methyl-2H-1,5-benzodioxepin-3(4H)-one
CAS Registry Number®
28940-11-6
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CAS Name
7-Methyl-2H-1,5-benzodioxepin-3(4H)-oneMolecular Formula
C10H10O3Molecular Mass
178.18Cite this Page
7-Methyl-2H-1,5-benzodioxepin-3(4H)-one. CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. http://commonchemistry.cas.org/detail?ref=28940-11-6 (retrieved ) (CAS RN: 28940-11-6). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).Compound Properties
Boiling Point (1)
71-82 °C @ Press: 0.01 TorrMelting Point (2)
38-39 °C
Source(s)
- (1) Denotes property values from the ZIC/VINITI data file provided by InfoChem.
- (2) Drevermann, Britta; Helvetica Chimica Acta, (2007), 90(5), 1006-1027, CAplus
Other Names and Identifiers
InChI
InChI=1S/C10H10O3/c1-7-2-3-9-10(4-7)13-6-8(11)5-12-9/h2-4H,5-6H2,1H3
InChIKey
InChIKey=SWUIQEBPZIHZQS-UHFFFAOYSA-N
SMILES
CC=1C=C2C(=CC1)OCC(=O)CO2
Canonical SMILES
O=C1COC2=CC=C(C=C2OC1)C
Other Names for this Substance
- 2H-1,5-Benzodioxepin-3(4H)-one, 7-methyl-
- 7-Methyl-2H-1,5-benzodioxepin-3(4H)-one
- Calone 1951
- Watermelon ketone
- Calone
Deleted or Replaced CAS Registry Numbers
35783-05-2
