Propanenitrile, 2-(2,5-dimethylphenoxy)-
TL;DR: Propanenitrile, 2-(2,5-dimethylphenoxy)- (CAS 6441-15-2) is a chemical compound with molecular formula C11H13NO and molecular weight 175.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(2,5-dimethylphenoxy)propanenitrile
Also Known As: Propanenitrile, 2-(2,5-dimethylphenoxy)-, 2-(2,5-dimethylphenoxy)propanenitrile
| Molecular Formula | C11H13NO |
|---|---|
| Molecular Weight | 175.10 g/mol |
| LogP | 2.59432 |
| Topological Polar Surface Area | 33.02 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 175.09972 |
| Heavy Atoms | 13 |
| Complexity | 338.43378 |
Chemical Identifiers
| CAS Number | 6441-15-2 |
|---|---|
| SMILES | CC1=CC(=C(C=C1)C)OC(C)C#N |
Product Overview
Propanenitrile, 2-(2,5-dimethylphenoxy)- (CAS 6441-15-2), with molecular formula C11H13NO and molecular weight 175.10 g/mol. IUPAC: 2-(2,5-dimethylphenoxy)propanenitrile.
Chemical Property Profile of Propanenitrile, 2-(2,5-dimethylphenoxy)-
Property Insights of Propanenitrile, 2-(2,5-dimethylphenoxy)-
The XLogP value of 2.59432 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Propanenitrile, 2-(2,5-dimethylphenoxy)-. With a topological polar surface area (TPSA) of 33.02 Ų, Propanenitrile, 2-(2,5-dimethylphenoxy)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Propanenitrile, 2-(2,5-dimethylphenoxy)- has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Propanenitrile, 2-(2,5-dimethylphenoxy)-?
The CAS number of Propanenitrile, 2-(2,5-dimethylphenoxy)- is 6441-15-2.
What is the molecular formula of Propanenitrile, 2-(2,5-dimethylphenoxy)-?
The molecular formula of Propanenitrile, 2-(2,5-dimethylphenoxy)- is C11H13NO.
What is the molecular weight of Propanenitrile, 2-(2,5-dimethylphenoxy)-?
The molecular weight of Propanenitrile, 2-(2,5-dimethylphenoxy)- is 175.10 g/mol.
Where can I buy Propanenitrile, 2-(2,5-dimethylphenoxy)-?
You can request a quote for Propanenitrile, 2-(2,5-dimethylphenoxy)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Propanenitrile, 2-(2,5-dimethylphenoxy)-?
Yes, KEHONG BIO provides custom synthesis services for Propanenitrile, 2-(2,5-dimethylphenoxy)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.