4-(Methylnitrosamino)-1-(3-Pyridyl)-1-Butanol
N-(4-hydroxy-4-pyridin-3-ylbutyl)-N-methylnitrous amide
Also Known As: nnal|4-(Methylnitrosamino)-1-(3-pyridyl)-1-butanol|Racemic NNAL|NNAL cpd|MNAPB cpd|racNNAL|rac NNAL|Quinuclidin-3-yl methanesulfonate|(+/-)-NNAL|4-(Methylnitrosoamino)-1-(3-pyridyl)-1-butanol|N-(4-hydroxy-4-pyridin-3-ylbutyl)-N-methylnitrous amide|Nicotine-Derived Nitrosamine Alcohol|Tox21_303708|4-(N-Methyl-N-nitrosamino)-1-(3-pyridyl)butan-1-ol|NNAL, (+/-)-|N-Nitroso-Cotinine Impurity 2(NNAL)|LS-7522|NCGC00357282-01|4-(methylnitrosoamino)-1--(3-pyridyl)-1-butanol|alpha-(3-(Methylnitrosoamino)propyl)-3-pyridinemethanol|SID:350085947|4-(methylnitrosamino)-1-(3-pyridyl)-1-butan-1-ol|CAS-76014-81-8|4-[methyl(nitroso)amino]-1-(pyridin-3-yl)butan-1-ol|3-Pyridinemethanol, alpha-(3-(methylnitrosoamino)propyl)-
| Molecular Formula | C10H15N3O2 |
|---|---|
| Molecular Weight | 209.11642 g/mol |
| LogP | 1.51 |
| Topological Polar Surface Area | 65.79 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 209.11642 |
| Heavy Atoms | 15 |
| Complexity | 292.0 |
Chemical Identifiers
| CAS Number | 76014-81-8 |
|---|---|
| SMILES | CN(CCCC(C1=CN=CC=C1)O)N=O |
Product Overview
4-(Methylnitrosamino)-1-(3-Pyridyl)-1-Butanol (CAS 76014-81-8), with molecular formula C10H15N3O2 and molecular weight 209.11642 g/mol. IUPAC: N-(4-hydroxy-4-pyridin-3-ylbutyl)-N-methylnitrous amide.
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