Basic information
- CAS
60752-93-4- Standard SMILES
C#CC1([NH+]2CC(OC(=O)NCCC)C2)CCCCC1.[Cl-]- InChIKey
BSCIOZWHAFRQJY-UHFFFAOYSA-N- Molecular formula
- C15H25ClN2O2
- Average molar mass
- 300.82 g/mol
- Monoisotopic mass
- 300.1604557
Names & identifiers
- Preferred name
- Carbamic acid, propyl-, 1-(1-ethynylcyclohexyl)-3-azetidinyl ester, monohydrochloride
- IUPAC
- [1-(1-ethynylcyclohexyl)azetidin-1-ium-3-yl] N-propylcarbamate chloride
Names & synonyms
Carbamic acid, propyl-, 1-(1-ethynylcyclohexyl)-3-azetidinyl ester, monohydrochloride60752-93-4RefChem:1080976Propylcarbamic acid 1-(1-ethynylcyclohexyl)-3-azetidinyl ester hydrochloride
Database identifiers
- CAS
60752-93-4- PubChem CID
- 43458
Properties
Computed structural properties
- Topological polar surface area
- 42.8 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 6
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 360
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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