1-Ethynylcyclododecanol
Basic information
- CAS
14519-31-4- Standard SMILES
C#CC1(O)CCCCCCCCCCC1- InChIKey
DCHDUZYXRMNPCU-UHFFFAOYSA-N- Molecular formula
- C14H24O
- Average molar mass
- 208.34 g/mol
- Monoisotopic mass
- 208.18271539
Names & identifiers
- Preferred name
- 1-Ethynylcyclododecanol
- IUPAC
- 1-ethynylcyclododecan-1-ol
- English name
- 1-Ethynyl-cyclododecanol
- Molecular formula
- C14H24O
- Molecular weight
- 208.34
Names & synonyms
1-ethynylcyclododecanol14519-31-4DTXSID80385185RefChem:1055475DTXCID303362081-ethynylcyclododecan-1-olCyclododecanol, 1-ethynyl-1-Hydroxy-1-ethynylcyclododecaneHMS1578O07SCHEMBL4414709DCHDUZYXRMNPCU-UHFFFAOYSA-NBBL018507
Show more names
1-Ethynyl-cyclododecanol
MFCD00483154STK020639AKOS005378582VS-06696CS-0334064
Database identifiers
- CAS
14519-31-4- PubChem CID
- 2828296
- DTXSID
DTXSID80385185- Nikkaji
- J1.465.585I
Properties
Computed structural properties
- XLogP
- 5
- Topological polar surface area
- 20.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 1
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 199
Physicochemical properties
- Hazard Codes
- Xn
- Risk Statements
- 22 · 22
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
- risk_code
- 22
- hazard_code
- Xn
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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