Benzoic acid, p-amino-, 2-((1-isobutyl-3-methylbutyl)amino)propyl ester, hydrochloride
Basic information
- CAS
69815-34-5- Standard SMILES
CC(C)CC(CC(C)C)[NH2+]C(C)COC(=O)c1ccc(N)cc1.[Cl-]- InChIKey
FBXXFJPTFWRXRI-UHFFFAOYSA-N- Molecular formula
- C19H33ClN2O2
- Average molar mass
- 356.9 g/mol
- Monoisotopic mass
- 356.223056
Names & identifiers
- Preferred name
- Benzoic acid, p-amino-, 2-((1-isobutyl-3-methylbutyl)amino)propyl ester, hydrochloride
- IUPAC
- 1-(4-aminobenzoyl)oxypropan-2-yl-(2,6-dimethylheptan-4-yl)azanium chloride
Names & synonyms
Benzoic acid, p-amino-, 2-((1-isobutyl-3-methylbutyl)amino)propyl ester, hydrochloride69815-34-5RefChem:1079273p-Aminobenzoic acid 2-((1-isobutyl-3-methylbutyl)amino)propyl ester hydrochlorideNSC 119618
Database identifiers
- CAS
69815-34-5- PubChem CID
- 50901
Properties
Computed structural properties
- Topological polar surface area
- 68.9 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 10
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 326
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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