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Structure

7-tert-Butyl-1,5-benzodioxepin-3(4H)-one

CAS
195251-91-3
Catalog Number
ACM195251913
Category
Other Products
Molecular Weight
220.264340 [g/mol]
Molecular Formula
C13H16O3

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Specification

Synonyms
195251-91-3, SureCN2348342, AGN-PC-014UE5, CTK4E1717, AG-E-42702, 7-tert-butyl-1,5-benzodioxepin-3-one, 7-TERT-BUTYL-1,5-BENZODIOXEPIN-3(4H)-ONE, 2H-1,5-Benzodioxepin-3(4H)-one,7-(1,1-dimethylethyl)-, 7-tert-butyl-1,5-benzodioxepin-3(4h)-one;2H-1,5-Benzodioxepin-3(4H)-on, 7-(1,1-dimethylethyl)-
IUPAC Name
7-tert-butyl-1,5-benzodioxepin-3-one
Canonical SMILES
CC(C)(C)C1=CC2=C(C=C1)OCC(=O)CO2
InChI Key
VFQHMVHBTUURKJ-UHFFFAOYSA-N
Boiling Point
323.271ºC at 760 mmHg
Flash Point
140.354ºC
Density
1.105g/cm³
EC Number
606-333-3
Exact Mass
220.11000
H-Bond Acceptor
3
H-Bond Donor
0
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