Benzoic acid, p-amino-, 2-(1-(1-cyclohexyl)ethylamino)-1,1-dimethylethyl ester
Basic information
- CAS
73698-73-4- Standard SMILES
CC(NCC(C)(C)OC(=O)c1ccc(N)cc1)C1CCCCC1- InChIKey
CAJCAGMTZGUUBB-UHFFFAOYSA-N- Molecular formula
- C19H30N2O2
- Average molar mass
- 318.5 g/mol
- Monoisotopic mass
- 318.2307282
Names & identifiers
- Preferred name
- Benzoic acid, p-amino-, 2-(1-(1-cyclohexyl)ethylamino)-1,1-dimethylethyl ester
- IUPAC
- [1-(1-cyclohexylethylamino)-2-methylpropan-2-yl] 4-aminobenzoate
- English name
- 2-(1-Cyclohexylethylamino)-1,1-dimethylethyl=p-aminobenzoate
- Molecular formula
- C19H30N2O2
- Molecular weight
- 318.45
Names & synonyms
73698-73-4p-Aminobenzoic acid 2-(1-(1-cyclohexyl)ethylamino)-1,1-dimethylethyl esterBENZOIC ACID, p-AMINO-, 2-(1-(1-CYCLOHEXYL)ETHYLAMINO)-1,1-DIMETHYLETHYL ESTERRefChem:327892DTXSID809945591-[(1-cyclohexylethyl)amino]-2-methylpropan-2-yl 4-aminobenzoate2-(1-Cyclohexylethylamino)-1,1-dimethylethyl=p-aminobenzoate2-Propanol, 1-[(1-cyclohexylethyl)amino]-2-methyl-, 2-(4-aminobenzoate)
Database identifiers
- CAS
73698-73-4- PubChem CID
- 52242
- DTXSID
DTXSID80994559- Nikkaji
- J73.827A
Properties
Computed structural properties
- XLogP
- 4.1
- Topological polar surface area
- 64.4 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 7
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 370
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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