TL;DR: 3-(Methylnitrosoamino)propanoic acid (CAS 1215691-18-1) is a chemical compound with molecular formula C4H8N2O3 and molecular weight 132.0535 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-[methyl(nitroso)amino]propanoic acid
Also Known As: NMPA, 3-[methyl(nitroso)amino]propanoic acid, N-NITROSO-N-METHYL-3-AMINOPROPIONIC ACID, NNMAP, 3-(N-Nitroso-N-methylamino)propionic acid
| Molecular Formula | C4H8N2O3 |
| Molecular Weight | 132.0535 g/mol |
| XLogP | -0.3 |
| Topological Polar Surface Area (TPSA) | 70.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 132.0535 Da |
| Heavy Atoms | 9 |
| Complexity | 114.0 |
| SMILES | CN(CCC(=O)O)N=O |
| InChIKey | JZVIGHIXBBLOEB-UHFFFAOYSA-N |
The XLogP value of -0.3 indicates that 3-(Methylnitrosoamino)propanoic acid is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 70.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-(Methylnitrosoamino)propanoic acid. Following Lipinski's Rule of Five, 3-(Methylnitrosoamino)propanoic acid has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 3-(Methylnitrosoamino)propanoic acid is 1215691-18-1.
The molecular formula of 3-(Methylnitrosoamino)propanoic acid is C4H8N2O3.
The molecular weight of 3-(Methylnitrosoamino)propanoic acid is 132.0535 g/mol.
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