2-(Piperidin-1-yl)ethyl hydrogen benzylcarbonimidate--hydrogen chloride (1/1)
Basic information
- CAS
101491-50-3- Standard SMILES
O=C(NCc1ccccc1)OCC[NH+]1CCCCC1.[Cl-]- InChIKey
XWRGYLOIUVKZRS-UHFFFAOYSA-N- Molecular formula
- C15H23ClN2O2
- Average molar mass
- 298.81 g/mol
- Monoisotopic mass
- 298.1448057
Names & identifiers
- Preferred name
- 2-(Piperidin-1-yl)ethyl hydrogen benzylcarbonimidate--hydrogen chloride (1/1)
- IUPAC
- 2-piperidin-1-ium-1-ylethyl N-benzylcarbamate chloride
Names & synonyms
101491-50-3DTXSID909062292-(Piperidin-1-yl)ethyl hydrogen benzylcarbonimidate--hydrogen chloride (1/1)RefChem:1062017DTXCID2013353272-Piperidinoethyl benzylcarbamate hydrochlorideCARBAMIC ACID, BENZYL-, 2-PIPERIDINOETHYL ESTER, MONOHYDROCHLORIDE
Database identifiers
- CAS
101491-50-3- PubChem CID
- 58417
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
- 259
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Compound notes
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