Basic information
- CAS
101491-69-4- Standard SMILES
CC[NH+](CC)CCNC(=O)OCCCc1ccccc1.[Cl-]- InChIKey
LIBRAQNHRIRHEH-UHFFFAOYSA-N- Molecular formula
- C16H27ClN2O2
- Average molar mass
- 314.8 g/mol
- Monoisotopic mass
- 314.1761058
Names & identifiers
- Preferred name
- Carbamic acid, (2-(diethylamino)ethyl)-, 3-phenylpropyl ester, monohydrochloride
- IUPAC
- diethyl-[2-(3-phenylpropoxycarbonylamino)ethyl]azanium chloride
Names & synonyms
3-Phenylpropyl N-(2-(diethylamino)ethyl)carbamate hydrochloride101491-69-4CARBAMIC ACID, (2-(DIETHYLAMINO)ETHYL)-, 3-PHENYLPROPYL ESTER, MONOHYDROCHLORIDERefChem:331856
Database identifiers
- CAS
101491-69-4- PubChem CID
- 58445
Properties
Computed structural properties
- Topological polar surface area
- 42.8 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 10
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 249
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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