Basic information
- CAS
73713-59-4- Standard SMILES
CC[NH+](CC)CCCCCOC(=O)c1ccccc1.[Cl-]- InChIKey
LWJUHLLDIFRVSQ-UHFFFAOYSA-N- Molecular formula
- C16H26ClNO2
- Average molar mass
- 299.83 g/mol
- Monoisotopic mass
- 299.1652068
Names & identifiers
- Preferred name
- 5-(Diethylamino)pentyl benzoate--hydrogen chloride (1/1)
- IUPAC
- 5-benzoyloxypentyl(diethyl)azanium chloride
Names & synonyms
73713-59-4DTXSID109945825-(Diethylamino)pentyl benzoate--hydrogen chloride (1/1)RefChem:1072521DTXCID001421615BENZOIC ACID, 5-(DIETHYLAMINO)PENTYL ESTER, HYDROCHLORIDE5-(Diethylamino)-1-pentyl benzoate hydrochlorideBenzoate du diethylamino-pentanol chlorhydrate [French]1-Pentanol, 5-(diethylamino)-, benzoate, hydrochlorideBenzoate du diethylamino-pentanol chlorhydrate
Database identifiers
- CAS
73713-59-4- PubChem CID
- 52260
Properties
Computed structural properties
- Topological polar surface area
- 30.7 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 10
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 233
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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