Basic information
- CAS
69781-52-8- Standard SMILES
CCCCCCCCCC[NH2+]C(C)(C)COC(=O)c1ccc(N)cc1.[Cl-]- InChIKey
KDCRPXNJSQXXDM-UHFFFAOYSA-N- Molecular formula
- C21H37ClN2O2
- Average molar mass
- 385 g/mol
- Monoisotopic mass
- 384.2543561
Names & identifiers
- Preferred name
- 2-(Decylamino)-2-methylpropyl 4-aminobenzoate--hydrogen chloride (1/1)
- IUPAC
- [1-(4-aminobenzoyl)oxy-2-methylpropan-2-yl]-decylazanium chloride
Names & synonyms
69781-52-8DTXSID709899942-(Decylamino)-2-methylpropyl 4-aminobenzoate--hydrogen chloride (1/1)RefChem:1061546DTXCID201417101p-Aminobenzoic acid (2-(decylamino)-2-methyl)propyl ester hydrochlorideBENZOIC ACID, p-AMINO-, (2-(DECYLAMINO)-2-METHYL)PROPYL ESTER, HYDROCHLORIDE
Database identifiers
- CAS
69781-52-8- PubChem CID
- 50801
Properties
Computed structural properties
- Topological polar surface area
- 68.9 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 14
- 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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