Basic information
- CAS
17599-20-1- Standard SMILES
CC[NH+](CC)CCCCOC(=O)c1ccc(N)cc1.[Cl-]- InChIKey
ZXKGSZDSZFCQHA-UHFFFAOYSA-N- Molecular formula
- C15H25ClN2O2
- Average molar mass
- 300.82 g/mol
- Monoisotopic mass
- 300.1604557
Names & identifiers
- Preferred name
- Benzoic acid, p-amino-, 4-(diethylamino)butyl ester, hydrochloride
- IUPAC
- 4-(4-aminobenzoyl)oxybutyl-diethylazanium chloride
Names & synonyms
BENZOIC ACID, p-AMINO-, 4-(DIETHYLAMINO)BUTYL ESTER, HYDROCHLORIDE17599-20-1RefChem:1079304p-Aminobenzoic acid 4-(diethylamino)butyl ester hydrochloride
Database identifiers
- CAS
17599-20-1- PubChem CID
- 28634
Properties
Computed structural properties
- Topological polar surface area
- 56.8 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 9
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 247
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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