3,3-Diethyl-1,5-dioxaspiro[5.5]undecan-9-one

HCID 67697693
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Basic information

Standard SMILES
CCC1(CC)COC2(CCC(=O)CC2)OC1
InChIKey
VYDMIBNODMXYDE-UHFFFAOYSA-N
Molecular formula
C13H22O3
Average molar mass
226.31 g/mol

Names & identifiers

Preferred name
3,3-Diethyl-1,5-dioxaspiro[5.5]undecan-9-one
IUPAC
3,3-diethyl-1,5-dioxaspiro[5.5]undecan-9-one

Names & synonyms

SCHEMBL8807934VYDMIBNODMXYDE-UHFFFAOYSA-N3,3-diethyl-1,5-dioxaspiro[5.5]undecan-9-one

Database identifiers

PubChem CID
67697693

Properties

Computed structural properties

XLogP
1.8
Topological polar surface area
35.5 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
3
Rotatable bonds
2
Heavy atoms
16

Related reactions

3 records
New reaction record

Compound notes

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