4-Phenethyloxycarbonyloxy-decanoic Acid 3,7-dimethyl-oct-6-enyl-ester

HCID 54572040
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Basic information

Standard SMILES
CCCCCCC(CCC(=O)OCCC(C)CCC=C(C)C)OC(=O)OCCc1ccccc1
InChIKey
ZXZACZWNOLBMBI-UHFFFAOYSA-N
Molecular formula
C29H46O5
Average molar mass
474.7 g/mol

Names & identifiers

Preferred name
4-Phenethyloxycarbonyloxy-decanoic Acid 3,7-dimethyl-oct-6-enyl-ester
IUPAC
3,7-dimethyloct-6-enyl 4-(2-phenylethoxycarbonyloxy)decanoate

Names & synonyms

SCHEMBL5186601ZXZACZWNOLBMBI-UHFFFAOYSA-N4-Phenethyloxycarbonyloxy-decanoic Acid 3,7-dimethyl-oct-6-enyl-ester

Database identifiers

PubChem CID
54572040

Properties

Computed structural properties

XLogP
9.3
Topological polar surface area
61.8 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
5
Rotatable bonds
21
Heavy atoms
34

Related reactions

4 records
New reaction record

Compound notes

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