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6-Octadecyloxan-2-one

HCID 12965604
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Basic information

CAS
159190-67-7
Standard SMILES
CCCCCCCCCCCCCCCCCCC1CCCC(=O)O1
InChIKey
AMLCHZMSZWOLKV-UHFFFAOYSA-N
Molecular formula
C23H44O2
Average molar mass
352.6 g/mol
Monoisotopic mass
352.33413064

Names & identifiers

Preferred name
6-Octadecyloxan-2-one
IUPAC
6-octadecyloxan-2-one

Names & synonyms

6-octadecyloxan-2-oneTetrahydro-6-octadecyl-2H-pyran-2-oneDTXSID901287020159190-67-7

Database identifiers

CAS
159190-67-7
PubChem CID
12965604
DTXSID
DTXSID901287020
Nikkaji
J1.108.997F

Properties

Computed structural properties

XLogP
9.6
Topological polar surface area
26.3 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
2
Rotatable bonds
17
Heavy atoms
25
Formal charge
0
Complexity
300

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Compound notes

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