RefChem:333112
3-(azepan-1-ium-1-yl)propyl N-(2-nonoxyphenyl)carbamate chloride
Also Known As: RefChem:333112|BK-71|AC1L18SK|Carbanilic acid, o-(nonyloxy)-, 3-(hexahydro-1H-azepin-1-yl)propyl ester, hydrochloride|Carbamic acid, (2-(nonlyoxy)phenyl)-, 3-(hexahydro-1H-azepin-1-yl)propyl ester hydrochloride|o-(Nonyloxy)carbanilic acid 3-(hexahydro-1H-azepin-1-yl)propyl ester hydrochloride|3-(azepan-1-ium-1-yl)propyl N-(2-nonoxyphenyl)carbamate chloride
| Molecular Formula | C25H43ClN2O3 |
|---|---|
| Molecular Weight | 454.29623 g/mol |
| LogP | 2.22 |
| Topological Polar Surface Area | 52.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 14 |
| Exact Mass | 454.29623 |
| Heavy Atoms | 31 |
| Complexity | 577.6 |
Chemical Identifiers
| CAS Number | 68931-15-7 |
|---|---|
| SMILES | CCCCCCCCCOC1=CC=CC=C1NC(=O)OCCC[NH+]2CCCCCC2.[Cl-] |
Product Overview
RefChem:333112 (CAS 68931-15-7), with molecular formula C25H43ClN2O3 and molecular weight 454.29623 g/mol. IUPAC: 3-(azepan-1-ium-1-yl)propyl N-(2-nonoxyphenyl)carbamate chloride.
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