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Pentadecyl propanoate

HCID 20031233
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Basic information

CAS
66292-29-3
Standard SMILES
CCCCCCCCCCCCCCCOC(=O)CC
InChIKey
KOGHCXHJZNKSGC-UHFFFAOYSA-N
Molecular formula
C18H36O2
Average molar mass
284.5 g/mol
Monoisotopic mass
284.27153039

Names & identifiers

Preferred name
Pentadecyl propanoate
IUPAC
pentadecyl propanoate

Names & synonyms

pentadecyl propanoateSCHEMBL8378847SCHEMBL8378848SCHEMBL9290048DTXSID40135135966292-29-3

Database identifiers

CAS
66292-29-3
PubChem CID
20031233
DTXSID
DTXSID401351359
Nikkaji
J2.135.390F

Properties

Computed structural properties

XLogP
7.7
Topological polar surface area
26.3 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
2
Rotatable bonds
16
Heavy atoms
20
Formal charge
0
Complexity
202

Related reactions

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Compound notes

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On this pageBasic informationNames & identifiersPropertiesRelated reactionsCompound notes