4-Methyl-2,5-dioxabicyclo-[4,4,0]-decan-3-one

HCID 20516632
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Basic information

Standard SMILES
CC1OC2CCCCC2OC1=O
InChIKey
WSXLXVUGXHIIDV-UHFFFAOYSA-N
Molecular formula
C9H14O3
Average molar mass
170.21 g/mol

Names & identifiers

Preferred name
4-Methyl-2,5-dioxabicyclo-[4,4,0]-decan-3-one
IUPAC
2-methyl-4a,5,6,7,8,8a-hexahydrobenzo[b][1,4]dioxin-3-one

Names & synonyms

SCHEMBL5244970WSXLXVUGXHIIDV-UHFFFAOYSA-N4-methyl-2,5-dioxabicyclo-[4,4,0]-decan-3-one

Database identifiers

PubChem CID
20516632

Properties

Computed structural properties

XLogP
1.5
Topological polar surface area
35.5 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
3
Rotatable bonds
0
Heavy atoms
12

Related reactions

1 records
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Compound notes

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