2-Furancarbonitrile, 5-((4-methylphenyl)sulfonyl)-
TL;DR: 2-Furancarbonitrile, 5-((4-methylphenyl)sulfonyl)- (CAS 75745-88-9) is a chemical compound with molecular formula C12H9NO3S and molecular weight 247.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-(4-methylphenyl)sulfonylfuran-2-carbonitrile
Also Known As: 2-Furancarbonitrile, 5-((4-methylphenyl)sulfonyl)-, 5-((4-Methylphenyl)sulfonyl)-2-furancarbonitrile, 5-(4-methylphenyl)sulfonylfuran-2-carbonitrile, 5-(4-MethylPhenylsulfonyl)-2-furonitrile, 5-(Toluene-4-sulfonyl)-furan-2-carbonitrile
| Molecular Formula | C12H9NO3S |
|---|---|
| Molecular Weight | 247.03 g/mol |
| LogP | 2.2925 |
| Topological Polar Surface Area | 71.07 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 247.03032 |
| Heavy Atoms | 17 |
| Complexity | 675.28595 |
Chemical Identifiers
| CAS Number | 75745-88-9 |
|---|---|
| SMILES | CC1=CC=C(C=C1)S(=O)(=O)C2=CC=C(O2)C#N |
Product Overview
2-Furancarbonitrile, 5-((4-methylphenyl)sulfonyl)- (CAS 75745-88-9), with molecular formula C12H9NO3S and molecular weight 247.03 g/mol. IUPAC: 5-(4-methylphenyl)sulfonylfuran-2-carbonitrile.
Chemical Property Profile of 2-Furancarbonitrile, 5-((4-methylphenyl)sulfonyl)-
Property Insights of 2-Furancarbonitrile, 5-((4-methylphenyl)sulfonyl)-
The XLogP value of 2.2925 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Furancarbonitrile, 5-((4-methylphenyl)sulfonyl)-. The TPSA of 71.07 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Furancarbonitrile, 5-((4-methylphenyl)sulfonyl)-. Following Lipinski's Rule of Five, 2-Furancarbonitrile, 5-((4-methylphenyl)sulfonyl)- has 0 hydrogen bond donor(s) and 4 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-Furancarbonitrile, 5-((4-methylphenyl)sulfonyl)-?
The CAS number of 2-Furancarbonitrile, 5-((4-methylphenyl)sulfonyl)- is 75745-88-9.
What is the molecular formula of 2-Furancarbonitrile, 5-((4-methylphenyl)sulfonyl)-?
The molecular formula of 2-Furancarbonitrile, 5-((4-methylphenyl)sulfonyl)- is C12H9NO3S.
What is the molecular weight of 2-Furancarbonitrile, 5-((4-methylphenyl)sulfonyl)-?
The molecular weight of 2-Furancarbonitrile, 5-((4-methylphenyl)sulfonyl)- is 247.03 g/mol.
Where can I buy 2-Furancarbonitrile, 5-((4-methylphenyl)sulfonyl)-?
You can request a quote for 2-Furancarbonitrile, 5-((4-methylphenyl)sulfonyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Furancarbonitrile, 5-((4-methylphenyl)sulfonyl)-?
Yes, KEHONG BIO provides custom synthesis services for 2-Furancarbonitrile, 5-((4-methylphenyl)sulfonyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.