Basic information
- CAS
10521-40-1- Standard SMILES
CCC(C[NH+](CC)CC)OC(=O)C(c1ccccc1)c1ccccc1.[Cl-]- InChIKey
VDQNXXYLWOURQG-UHFFFAOYSA-N- Molecular formula
- C22H30ClNO2
- Average molar mass
- 375.9 g/mol
- Monoisotopic mass
- 375.1965069
Names & identifiers
- Preferred name
- 1-(Diethylamino)butan-2-yl diphenylacetate--hydrogen chloride (1/1)
- IUPAC
- 2-(2,2-diphenylacetyl)oxybutyl-diethylazanium chloride
Names & synonyms
DTXSID409093811-(Diethylamino)butan-2-yl diphenylacetate--hydrogen chloride (1/1)RefChem:1054653DTXCID001338444Diphenylacetic acid 1-((diethylamino)methyl)propyl ester hydrochloride10521-40-1ACETIC ACID, DIPHENYL-, 1-((DIETHYLAMINO)METHYL)PROPYL ESTER, HYDROCHLORIDE
Database identifiers
- CAS
10521-40-1- PubChem CID
- 25329
Properties
Computed structural properties
- Topological polar surface area
- 30.7 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 10
- Heavy atoms
- 26
- Formal charge
- 0
- Complexity
- 350
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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