(3E)-3-[[3,5-dimethyl-4-(phenylmethoxy)phenyl]methylene]-1,4-dioxaspiro[4.5]decan-2-one

HCID 59259697
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Basic information

Standard SMILES
Cc1cc(/C=C2/OC3(CCCCC3)OC2=O)cc(C)c1OCc1ccccc1
InChIKey
AQUIVZNKKCNBEA-RCCKNPSSSA-N
Molecular formula
C24H26O4
Average molar mass
378.5 g/mol

Names & identifiers

Preferred name
(3E)-3-[[3,5-dimethyl-4-(phenylmethoxy)phenyl]methylene]-1,4-dioxaspiro[4.5]decan-2-one
IUPAC
(2E)-2-[(3,5-dimethyl-4-phenylmethoxyphenyl)methylidene]-1,4-dioxaspiro[4.5]decan-3-one

Names & synonyms

SCHEMBL651378AQUIVZNKKCNBEA-RCCKNPSSSA-N(3E)-3-[[3,5-dimethyl-4-(phenylmethoxy)phenyl]methylene]-1,4-dioxaspiro[4.5]decan-2-one

Database identifiers

PubChem CID
59259697

Properties

Computed structural properties

XLogP
6.1
Topological polar surface area
44.8 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
4
Rotatable bonds
4
Heavy atoms
28

Related reactions

3 records
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Compound notes

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