Basic information
- CAS
14224-80-7- Standard SMILES
O=C1CCC#CCCCCCCCCCC1- InChIKey
LAUIIEUKTSCRDN-UHFFFAOYSA-N- Molecular formula
- C15H24O
- Average molar mass
- 220.35 g/mol
- Monoisotopic mass
- 220.18271539
Names & identifiers
- Preferred name
- 4-Cyclopentadecyn-1-one
- IUPAC
- cyclopentadec-4-yn-1-one
Names & synonyms
4-Cyclopentadecyn-1-one14224-80-7RefChem:98678604-281-6CYCLOPENTADEC-4-YN-1-ONESCHEMBL10877509LAUIIEUKTSCRDN-UHFFFAOYSA-NDTXSID501318885
Database identifiers
- CAS
14224-80-7- PubChem CID
- 12377464
- DTXSID
DTXSID501318885- EC Number
- 604-281-6
- Nikkaji
- J811.047F
Properties
Computed structural properties
- XLogP
- 4.8
- Topological polar surface area
- 17.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 0
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 253
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
GHS classification
GHS ClassificationNot Classified
Hazard information
Regulatory InformationREACH registered substance: Cyclopentadec-4-yn-1-one (EC: 604-281-6)
Hazard Classes and CategoriesNot Classified
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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