TL;DR: N-Butyl-N-nitrosoformamide (CAS 14300-10-8) is a chemical compound with molecular formula C5H10N2O2 and molecular weight 130.07423 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N-butyl-N-nitrosoformamide
Also Known As: N-Butyl-N-nitrosoformamide, Dicyclopropylmethanol, Formamide, N-butyl-N-nitroso-, N-Butyl-N-nitroso-formamid, NSC 123132
| Molecular Formula | C5H10N2O2 |
| Molecular Weight | 130.07423 g/mol |
| XLogP | 0.7 |
| Topological Polar Surface Area (TPSA) | 49.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 130.07423 Da |
| Heavy Atoms | 9 |
| Complexity | 95.0 |
| SMILES | CCCCN(C=O)N=O |
| InChIKey | LYTFOMMQXICLRT-UHFFFAOYSA-N |
The XLogP value of 0.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-Butyl-N-nitrosoformamide. With a topological polar surface area (TPSA) of 49.7 Ų, N-Butyl-N-nitrosoformamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-Butyl-N-nitrosoformamide has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of N-Butyl-N-nitrosoformamide is 14300-10-8.
The molecular formula of N-Butyl-N-nitrosoformamide is C5H10N2O2.
The molecular weight of N-Butyl-N-nitrosoformamide is 130.07423 g/mol.
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