Benzoic acid, p-amino-, (2-(sec-butylamino)-1-methyl)ethyl ester, hydrochloride
Basic information
- CAS
74203-56-8- Standard SMILES
CCC(C)[NH2+]CC(C)OC(=O)c1ccc(N)cc1.[Cl-]- InChIKey
KQLXZGGYUHYFMD-UHFFFAOYSA-N- Molecular formula
- C14H23ClN2O2
- Average molar mass
- 286.8 g/mol
- Monoisotopic mass
- 286.1448057
Names & identifiers
- Preferred name
- Benzoic acid, p-amino-, (2-(sec-butylamino)-1-methyl)ethyl ester, hydrochloride
- IUPAC
- 2-(4-aminobenzoyl)oxypropyl-butan-2-ylazanium chloride
Names & synonyms
p-Aminobenzoic acid (2-(sec-butylamino)-1-methyl)ethyl ester hydrochlorideBENZOIC ACID, p-AMINO-, (2-(sec-BUTYLAMINO)-1-METHYL)ETHYL ESTER, HYDROCHLORIDE74203-56-8RefChem:327868
Database identifiers
- CAS
74203-56-8- PubChem CID
- 52979
Properties
Computed structural properties
- Topological polar surface area
- 68.9 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 7
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 250
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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