Propanenitrile, 3-(phosphonooxy)-, compd. with cyclohexanamine (1:2)
TL;DR: Propanenitrile, 3-(phosphonooxy)-, compd. with cyclohexanamine (1:2) (CAS 62654-09-5) is a chemical compound with molecular formula C15H32N3O4P and molecular weight 349.21304 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-cyanoethyl dihydrogen phosphate;bis(cyclohexanamine)
Also Known As: bis 2-cyanoethylphosphate, dicyclohexanaminium 2-cyanoethyl phosphate, Bis(cyclohexylammonium) 2-cyanoethyl phosphate, Propanenitrile, 3-(phosphonooxy)-, compd. with cyclohexanamine (1:2), bis-(Cyclohexylammonium) 2-cyanoethyl phosphate
Technical Specifications
| Molecular Formula | C15H32N3O4P |
| Molecular Weight | 349.21304 g/mol |
| XLogP | 2.56 |
| Topological Polar Surface Area (TPSA) | 143.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 3 |
| Exact Mass | 349.21304 Da |
| Heavy Atoms | 23 |
| Complexity | 210.0 |
| SMILES | C1CCC(CC1)N.C1CCC(CC1)N.C(COP(=O)(O)O)C#N |
| InChIKey | QSDZRMXWHBMBOP-UHFFFAOYSA-N |
Chemical Property Profile of Propanenitrile, 3-(phosphonooxy)-, compd. with cyclohexanamine (1:2)
Property Insights of Propanenitrile, 3-(phosphonooxy)-, compd. with cyclohexanamine (1:2)
The XLogP value of 2.56 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Propanenitrile, 3-(phosphonooxy)-, compd. with cyclohexanamine (1:2). The TPSA of 143.0 Ų indicates high polarity, suggesting Propanenitrile, 3-(phosphonooxy)-, compd. with cyclohexanamine (1:2) may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Propanenitrile, 3-(phosphonooxy)-, compd. with cyclohexanamine (1:2) has 4 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of Propanenitrile, 3-(phosphonooxy)-, compd. with cyclohexanamine (1:2)?
The CAS number of Propanenitrile, 3-(phosphonooxy)-, compd. with cyclohexanamine (1:2) is 62654-09-5.
What is the molecular formula of Propanenitrile, 3-(phosphonooxy)-, compd. with cyclohexanamine (1:2)?
The molecular formula of Propanenitrile, 3-(phosphonooxy)-, compd. with cyclohexanamine (1:2) is C15H32N3O4P.
What is the molecular weight of Propanenitrile, 3-(phosphonooxy)-, compd. with cyclohexanamine (1:2)?
The molecular weight of Propanenitrile, 3-(phosphonooxy)-, compd. with cyclohexanamine (1:2) is 349.21304 g/mol.
Where can I buy Propanenitrile, 3-(phosphonooxy)-, compd. with cyclohexanamine (1:2)?
You can request a quote for Propanenitrile, 3-(phosphonooxy)-, compd. with cyclohexanamine (1:2) directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Propanenitrile, 3-(phosphonooxy)-, compd. with cyclohexanamine (1:2)?
Yes, CoreyChem provides custom synthesis services for Propanenitrile, 3-(phosphonooxy)-, compd. with cyclohexanamine (1:2) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.