Basic information
- CAS
74038-55-4- Standard SMILES
CC[NH+](CC)CCOC(=O)C(CCC(C)C)c1ccccc1.[Cl-]- InChIKey
JWRAXFUJJYXTFZ-UHFFFAOYSA-N- Molecular formula
- C19H32ClNO2
- Average molar mass
- 341.9 g/mol
- Monoisotopic mass
- 341.212157
Names & identifiers
- Preferred name
- Hexanoic acid, 5-methyl-2-phenyl-, 2-(diethylamino)ethyl ester, hydrochloride
- IUPAC
- diethyl-[2-(5-methyl-2-phenylhexanoyl)oxyethyl]azanium chloride
Names & synonyms
HEXANOIC ACID, 5-METHYL-2-PHENYL-, 2-(DIETHYLAMINO)ETHYL ESTER, HYDROCHLORIDE74038-55-4RefChem:10866192-(Diethylamino)ethyl 5-methyl-2-phenylhexanoate hydrochlorideIsoamyl-phenylacetate du diethylamino-ethanol chlorhydrate [French]Ethanol, 2-(diethylamino)-, 5-methyl-2-phenylhexanoate, hydrochlorideIsoamyl-phenylacetate du diethylamino-ethanol chlorhydrate
Database identifiers
- CAS
74038-55-4- PubChem CID
- 52871
Properties
Computed structural properties
- Topological polar surface area
- 30.7 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 11
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 294
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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