Basic information
- CAS
28558-49-8- Standard SMILES
O=C(NCC[NH+]1CCCCC1)OCCc1ccccc1.[Cl-]- InChIKey
BEHZHMWDLDVWNY-UHFFFAOYSA-N- Molecular formula
- C16H25ClN2O2
- Average molar mass
- 312.83 g/mol
- Monoisotopic mass
- 312.1604557
Names & identifiers
- Preferred name
- Carbamic acid, (2-piperidinoethyl)-, phenethyl ester, monohydrochloride
- IUPAC
- 2-phenylethyl N-(2-piperidin-1-ium-1-ylethyl)carbamate chloride
Names & synonyms
Phenethyl N-(2-piperidinoethyl)carbamate hydrochlorideCARBAMIC ACID, (2-PIPERIDINOETHYL)-, PHENETHYL ESTER, MONOHYDROCHLORIDE28558-49-8RefChem:331968
Database identifiers
- CAS
28558-49-8- PubChem CID
- 34278
Properties
Computed structural properties
- Topological polar surface area
- 42.8 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 7
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 272
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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