Benzoic acid, p-amino-, 2-((1-methylnonyl)amino)ethyl ester, hydrochloride
Basic information
- CAS
69781-00-6- Standard SMILES
CCCCCCCCC(C)[NH2+]CCOC(=O)c1ccc(N)cc1.[Cl-]- InChIKey
IUUYPHZPCAEIJV-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-methylnonyl)amino)ethyl ester, hydrochloride
- IUPAC
- 2-(4-aminobenzoyl)oxyethyl-decan-2-ylazanium chloride
Names & synonyms
BENZOIC ACID, p-AMINO-, 2-((1-METHYLNONYL)AMINO)ETHYL ESTER, HYDROCHLORIDE69781-00-6RefChem:1079277p-Aminobenzoic acid 2-((1-methylnonyl)amino)ethyl ester hydrochlorideNSC 121064
Database identifiers
- CAS
69781-00-6- PubChem CID
- 50728
Properties
Computed structural properties
- Topological polar surface area
- 68.9 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 13
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 302
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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