Basic information
- CAS
3537-83-5- Standard SMILES
O=C1CCCCCCCCCCCCCO1- InChIKey
LFSYLMRHJKGLDV-UHFFFAOYSA-N- Molecular formula
- C14H26O2
- Average molar mass
- 226.35 g/mol
- Monoisotopic mass
- 226.19328007
Names & identifiers
- Preferred name
- Oxacyclopentadecan-2-one
- IUPAC
- oxacyclopentadecan-2-one
- English name
- 1-Oxacyclopentadecan-2-one
- Molecular formula
- C14H26O2
- Molecular weight
- 226.35
Names & synonyms
Oxacyclopentadecan-2-oneCyclotetradecanolide3537-83-5DTXSID6063064RefChem:857017DTXCID60390011-oxacyclopentadecan-2-onetetradecanolideTetradecanolactonetetradecano-14-lactoneSCHEMBL918482
Database identifiers
- CAS
3537-83-5- PubChem CID
- 77076
- DTXSID
DTXSID6063064- Nikkaji
- J254.030D
Properties
Computed structural properties
- XLogP
- 5.2
- Topological polar surface area
- 26.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 0
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 178
Physicochemical properties
- Melting point
- 142 · 142-145 °C
- Boiling point
- 110 · 110-112 °C(Press: 2 Torr)
- Density
- 0.953 g/cm3 · 0.9530 g/cm3(Temp: 30 °C)
- LogP
- 4.639 · 4.639 (est)
- EPA Substance Registry System
- -2 · Oxacyclopentadecan-2-one (3537-83-5)
- TSCA
- TSCA listed
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- tsca
- TSCA listed
Chemistry & industry
Uses & manufacturing
General Manufacturing InformationOxacyclopentadecan-2-one: INACTIVE
Related reactions
1 records
Compound notes
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