RefChem:869007
TL;DR: RefChem:869007 (CAS 53067-27-9) is a chemical compound with molecular formula C15H23N3O3 and molecular weight 293.17395 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-[2,2-bis(2-cyanoethoxymethyl)butoxy]propanenitrile
Also Known As: 3-{2,2-bis[(2-cyanoethoxy)methyl]butoxy}propanenitrile, 3-[2,2-bis(2-cyanoethoxymethyl)butoxy]propanenitrile, Propanenitrile, 3,3'-((2-((2-cyanoethoxy)methyl)-2-ethyl-1,3-propanediyl)bis(oxy))bis-, Propanenitrile, 3,3'-[[2-[(2-cyanoethoxy)methyl]-2-ethyl-1,3-propanediyl]bis(oxy)]bis-, 3,3'-[[2-[ methyl]-2-ethyl-1,3-propanediyl]bis ]bis[propanenitrile]
Technical Specifications
| Molecular Formula | C15H23N3O3 |
| Molecular Weight | 293.17395 g/mol |
| XLogP | -0.1 |
| Topological Polar Surface Area (TPSA) | 99.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 13 |
| Exact Mass | 293.17395 Da |
| Heavy Atoms | 21 |
| Complexity | 350.0 |
| SMILES | CCC(COCCC#N)(COCCC#N)COCCC#N |
| InChIKey | MVIGWYTVWUNJIO-UHFFFAOYSA-N |
Chemical Property Profile of RefChem:869007
Property Insights of RefChem:869007
The XLogP value of -0.1 indicates that RefChem:869007 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 99.1 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:869007. Following Lipinski's Rule of Five, RefChem:869007 has 0 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of RefChem:869007?
The CAS number of RefChem:869007 is 53067-27-9.
What is the molecular formula of RefChem:869007?
The molecular formula of RefChem:869007 is C15H23N3O3.
What is the molecular weight of RefChem:869007?
The molecular weight of RefChem:869007 is 293.17395 g/mol.
Where can I buy RefChem:869007?
You can request a quote for RefChem:869007 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for RefChem:869007?
Yes, CoreyChem provides custom synthesis services for RefChem:869007 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.