Basic information
- CAS
51149-68-9- Standard SMILES
CCOC(C#CC1CCCC1)OCC- InChIKey
XSELNVVDWXTODF-UHFFFAOYSA-N- Molecular formula
- C12H20O2
- Average molar mass
- 196.29 g/mol
- Monoisotopic mass
- 196.14632988
Names & identifiers
- Preferred name
- 3,3-Diethoxyprop-1-ynylcyclopentane
- IUPAC
- 3,3-diethoxyprop-1-ynylcyclopentane
Names & synonyms
3,3-diethoxyprop-1-ynylcyclopentane51149-68-9NSC244917DTXSID30311696NSC-244917(3,3-Diethoxyprop-1-yn-1-yl)cyclopentaneDS-013892
Database identifiers
- CAS
51149-68-9- PubChem CID
- 316614
- DTXSID
DTXSID30311696
Properties
Computed structural properties
- XLogP
- 3.1
- Topological polar surface area
- 18.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 4
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 199
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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