2-Methyl-2-phenylpropanenitrile
TL;DR: 2-Methyl-2-phenylpropanenitrile (CAS 278788-66-2) is a chemical compound with molecular formula C10H11N and molecular weight 145.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-methyl-2-phenylpropanenitrile
Also Known As: 2-methyl-2-phenylpropanenitrile, phenylisobutyronitrile, Loxoprofen Impurity N5, benzeneacetonitrile, alpha,alpha-dimethyl-, 2-methyl-2-phenyl-propionitrile
| Molecular Formula | C10H11N |
|---|---|
| Molecular Weight | 145.09 g/mol |
| LogP | 2.48778 |
| Topological Polar Surface Area | 23.79 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 145.08914 |
| Heavy Atoms | 11 |
| Complexity | 266.6743 |
Chemical Identifiers
| CAS Number | 278788-66-2 |
|---|---|
| SMILES | CC(C)(C#N)C1=CC=CC=C1 |
Product Overview
2-Methyl-2-phenylpropanenitrile (CAS 278788-66-2), with molecular formula C10H11N and molecular weight 145.09 g/mol. IUPAC: 2-methyl-2-phenylpropanenitrile.
Chemical Property Profile of 2-Methyl-2-phenylpropanenitrile
Property Insights of 2-Methyl-2-phenylpropanenitrile
The XLogP value of 2.48778 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Methyl-2-phenylpropanenitrile. With a topological polar surface area (TPSA) of 23.79 Ų, 2-Methyl-2-phenylpropanenitrile exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Methyl-2-phenylpropanenitrile has 0 hydrogen bond donor(s) and 1 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 2-Methyl-2-phenylpropanenitrile?
The CAS number of 2-Methyl-2-phenylpropanenitrile is 278788-66-2.
What is the molecular formula of 2-Methyl-2-phenylpropanenitrile?
The molecular formula of 2-Methyl-2-phenylpropanenitrile is C10H11N.
What is the molecular weight of 2-Methyl-2-phenylpropanenitrile?
The molecular weight of 2-Methyl-2-phenylpropanenitrile is 145.09 g/mol.
Where can I buy 2-Methyl-2-phenylpropanenitrile?
You can request a quote for 2-Methyl-2-phenylpropanenitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Methyl-2-phenylpropanenitrile?
Yes, KEHONG BIO provides custom synthesis services for 2-Methyl-2-phenylpropanenitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.