2-Methyl-2-(4-nitrophenyl)propanenitrile
TL;DR: 2-Methyl-2-(4-nitrophenyl)propanenitrile (CAS 7251-60-7) is a chemical compound with molecular formula C10H10N2O2 and molecular weight 190.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-methyl-2-(4-nitrophenyl)propanenitrile
Also Known As: 2-methyl-2-(4-nitrophenyl)propanenitrile, 2-Methyl-2-(4-nitrophenyl)propionitrile, 2-methyl-2-(4-nitrophenyl)propanonitril, 2-{4-nitrophenyl}-2-methylpropanenitrile, 2-methyl-2-(4-nitro-phenyl)-propionitrile
| Molecular Formula | C10H10N2O2 |
|---|---|
| Molecular Weight | 190.07 g/mol |
| LogP | 2.39598 |
| Topological Polar Surface Area | 66.93 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 190.07423 |
| Heavy Atoms | 14 |
| Complexity | 387.5782 |
Chemical Identifiers
| CAS Number | 7251-60-7 |
|---|---|
| SMILES | CC(C)(C#N)C1=CC=C(C=C1)[N+](=O)[O-] |
Product Overview
2-Methyl-2-(4-nitrophenyl)propanenitrile (CAS 7251-60-7), with molecular formula C10H10N2O2 and molecular weight 190.07 g/mol. IUPAC: 2-methyl-2-(4-nitrophenyl)propanenitrile.
Chemical Property Profile of 2-Methyl-2-(4-nitrophenyl)propanenitrile
Property Insights of 2-Methyl-2-(4-nitrophenyl)propanenitrile
The XLogP value of 2.39598 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Methyl-2-(4-nitrophenyl)propanenitrile. The TPSA of 66.93 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Methyl-2-(4-nitrophenyl)propanenitrile. Following Lipinski's Rule of Five, 2-Methyl-2-(4-nitrophenyl)propanenitrile has 0 hydrogen bond donor(s) and 3 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-(4-nitrophenyl)propanenitrile?
The CAS number of 2-Methyl-2-(4-nitrophenyl)propanenitrile is 7251-60-7.
What is the molecular formula of 2-Methyl-2-(4-nitrophenyl)propanenitrile?
The molecular formula of 2-Methyl-2-(4-nitrophenyl)propanenitrile is C10H10N2O2.
What is the molecular weight of 2-Methyl-2-(4-nitrophenyl)propanenitrile?
The molecular weight of 2-Methyl-2-(4-nitrophenyl)propanenitrile is 190.07 g/mol.
Where can I buy 2-Methyl-2-(4-nitrophenyl)propanenitrile?
You can request a quote for 2-Methyl-2-(4-nitrophenyl)propanenitrile 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-(4-nitrophenyl)propanenitrile?
Yes, KEHONG BIO provides custom synthesis services for 2-Methyl-2-(4-nitrophenyl)propanenitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.