Propanenitrile, 2-methyl-2-(methylsulfonyl)-
TL;DR: Propanenitrile, 2-methyl-2-(methylsulfonyl)- (CAS 14668-29-2) is a chemical compound with molecular formula C5H9NO2S and molecular weight 147.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-methyl-2-methylsulfonylpropanenitrile
Also Known As: 2-Methanesulfonyl-2-methylpropanenitrile, 2-Methyl-2-(methylsulfonyl)propanenitrile, 2-methyl-2-methylsulfonylpropanenitrile, Propanenitrile, 2-methyl-2-(methylsulfonyl)-, methyl-2-(methylsulfonyl)propionitrile
| Molecular Formula | C5H9NO2S |
|---|---|
| Molecular Weight | 147.04 g/mol |
| LogP | 0.33318 |
| Topological Polar Surface Area | 57.93 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 147.0354 |
| Heavy Atoms | 9 |
| Complexity | 232.17383 |
Chemical Identifiers
| CAS Number | 14668-29-2 |
|---|---|
| SMILES | CC(C)(C#N)S(=O)(=O)C |
Product Overview
Propanenitrile, 2-methyl-2-(methylsulfonyl)- (CAS 14668-29-2), with molecular formula C5H9NO2S and molecular weight 147.04 g/mol. IUPAC: 2-methyl-2-methylsulfonylpropanenitrile.
Chemical Property Profile of Propanenitrile, 2-methyl-2-(methylsulfonyl)-
Property Insights of Propanenitrile, 2-methyl-2-(methylsulfonyl)-
The XLogP value of 0.33318 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Propanenitrile, 2-methyl-2-(methylsulfonyl)-. With a topological polar surface area (TPSA) of 57.93 Ų, Propanenitrile, 2-methyl-2-(methylsulfonyl)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Propanenitrile, 2-methyl-2-(methylsulfonyl)- 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 Propanenitrile, 2-methyl-2-(methylsulfonyl)-?
The CAS number of Propanenitrile, 2-methyl-2-(methylsulfonyl)- is 14668-29-2.
What is the molecular formula of Propanenitrile, 2-methyl-2-(methylsulfonyl)-?
The molecular formula of Propanenitrile, 2-methyl-2-(methylsulfonyl)- is C5H9NO2S.
What is the molecular weight of Propanenitrile, 2-methyl-2-(methylsulfonyl)-?
The molecular weight of Propanenitrile, 2-methyl-2-(methylsulfonyl)- is 147.04 g/mol.
Where can I buy Propanenitrile, 2-methyl-2-(methylsulfonyl)-?
You can request a quote for Propanenitrile, 2-methyl-2-(methylsulfonyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Propanenitrile, 2-methyl-2-(methylsulfonyl)-?
Yes, KEHONG BIO provides custom synthesis services for Propanenitrile, 2-methyl-2-(methylsulfonyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.