TL;DR: Pentanenitrile, 2-[(1-cyano-3-methylbutyl)azo]-2-methyl- (CAS 15457-18-8) is a chemical compound with molecular formula C12H20N4 and molecular weight 220.1688 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-[(1-cyano-3-methylbutyl)diazenyl]-2-methylpentanenitrile
Also Known As: 2,4'-Dimethyl-2,2'-azodivaleronitrile, 3-benzoylpiperidine hydrochloride, 2,4/'-Dimethyl-2,2/'-azodivaleronitrile, 2-[(1-cyano-3-methylbutyl)diazenyl]-2-methylpentanenitrile, Valeronitrile, 2,4'-dimethyl-2,2'-azodi-
| Molecular Formula | C12H20N4 |
| Molecular Weight | 220.1688 g/mol |
| XLogP | 3.4 |
| Topological Polar Surface Area (TPSA) | 72.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 220.1688 Da |
| Heavy Atoms | 16 |
| Complexity | 327.0 |
| SMILES | CCCC(C)(C#N)N=NC(CC(C)C)C#N |
| InChIKey | CVLPHLARBKIAPB-UHFFFAOYSA-N |
The XLogP value of 3.4 indicates that Pentanenitrile, 2-[(1-cyano-3-methylbutyl)azo]-2-methyl- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 72.3 Ų falls within the moderate polarity range, balancing permeability and solubility for Pentanenitrile, 2-[(1-cyano-3-methylbutyl)azo]-2-methyl-. Following Lipinski's Rule of Five, Pentanenitrile, 2-[(1-cyano-3-methylbutyl)azo]-2-methyl- has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of Pentanenitrile, 2-[(1-cyano-3-methylbutyl)azo]-2-methyl- is 15457-18-8.
The molecular formula of Pentanenitrile, 2-[(1-cyano-3-methylbutyl)azo]-2-methyl- is C12H20N4.
The molecular weight of Pentanenitrile, 2-[(1-cyano-3-methylbutyl)azo]-2-methyl- is 220.1688 g/mol.
You can request a quote for Pentanenitrile, 2-[(1-cyano-3-methylbutyl)azo]-2-methyl- directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Yes, CoreyChem provides custom synthesis services for Pentanenitrile, 2-[(1-cyano-3-methylbutyl)azo]-2-methyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.
Request a quote for CAS 15457-18-8. Our professional technical team will respond with pricing and lead time.