RefChem:368807
6-[ethyl-[1-(4-methoxyphenyl)propan-2-yl]amino]hexyl 3,4-dimethoxybenzoate
Also Known As: N-Ethyl-N-(6-hydroxyhexyl)-4-methoxy-alpha-methylphenethylamine 3,4-dimethoxybenzoate|Phenethylamine, N-ethyl-N-(6-hydroxyhexyl)-4-methoxy-alpha-methyl-, 3,4- dimethoxybenzoate (ester)|6-{ETHYL[1-(4-METHOXYPHENYL)PROPAN-2-YL]AMINO}HEXYL 3,4-DIMETHOXYBENZOATE|6-[ethyl-[1-(4-methoxyphenyl)propan-2-yl]amino]hexyl 3,4-dimethoxybenzoate|3,4-Dimethoxybenzoic acid 6-[ethyl(4-methoxy-alpha-methylphenethyl)amino]hexyl ester|Benzoic acid, 3,4-dimethoxy-, 6-[ethyl[2-(4-methoxyphenyl)-1-methylethyl]amino]hexyl ester|Phenethylamine, N-ethyl-N-(6-hydroxyhexyl)-4-methoxy-alpha-methyl-, 3,4-dimethoxybenzoate (ester)
| Molecular Formula | C27H39NO5 |
|---|---|
| Molecular Weight | 457.28284 g/mol |
| LogP | 5.9 |
| Topological Polar Surface Area | 57.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 16 |
| Exact Mass | 457.28284 |
| Monoisotopic Mass | 457.28284 |
| Heavy Atoms | 33 |
| Complexity | 523.0 |
Chemical Identifiers
| CAS Number | 67293-37-2 |
|---|---|
| SMILES | CCN(CCCCCCOC(=O)C1=CC(=C(C=C1)OC)OC)C(C)CC2=CC=C(C=C2)OC |
| InChIKey | VWBGYBVUPUPFET-UHFFFAOYSA-N |
Product Overview
RefChem:368807 (CAS 67293-37-2), with molecular formula C27H39NO5 and molecular weight 457.28284 g/mol. IUPAC: 6-[ethyl-[1-(4-methoxyphenyl)propan-2-yl]amino]hexyl 3,4-dimethoxybenzoate.