2-Methylprop-2-enylsulfonylmethylbenzene
TL;DR: 2-Methylprop-2-enylsulfonylmethylbenzene (CAS 502186-60-9) is a chemical compound with molecular formula C11H14O2S and molecular weight 210.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-methylprop-2-enylsulfonylmethylbenzene
Also Known As: benzyl-methallyl sulfone, (2-Methyl-2-propenyl)benzyl sulfone, 2-methylprop-2-enylsulfonylmethylbenzene, J1.639.883G, [(2-methylprop-2-ene-1-sulfonyl)methyl]benzene
| Molecular Formula | C11H14O2S |
|---|---|
| Molecular Weight | 210.07 g/mol |
| LogP | 2.4 |
| Topological Polar Surface Area | 42.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 210.07146 |
| Heavy Atoms | 14 |
| Complexity | 279.0 |
Chemical Identifiers
| CAS Number | 502186-60-9 |
|---|---|
| SMILES | CC(=C)CS(=O)(=O)CC1=CC=CC=C1 |
| InChIKey | CKRQVBTYKBQOBC-UHFFFAOYSA-N |
Product Overview
2-Methylprop-2-enylsulfonylmethylbenzene (CAS 502186-60-9), with molecular formula C11H14O2S and molecular weight 210.07 g/mol. IUPAC: 2-methylprop-2-enylsulfonylmethylbenzene.
Chemical Property Profile of 2-Methylprop-2-enylsulfonylmethylbenzene
Property Insights of 2-Methylprop-2-enylsulfonylmethylbenzene
The XLogP value of 2.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Methylprop-2-enylsulfonylmethylbenzene. With a topological polar surface area (TPSA) of 42.5 Ų, 2-Methylprop-2-enylsulfonylmethylbenzene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Methylprop-2-enylsulfonylmethylbenzene 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 2-Methylprop-2-enylsulfonylmethylbenzene?
The CAS number of 2-Methylprop-2-enylsulfonylmethylbenzene is 502186-60-9.
What is the molecular formula of 2-Methylprop-2-enylsulfonylmethylbenzene?
The molecular formula of 2-Methylprop-2-enylsulfonylmethylbenzene is C11H14O2S.
What is the molecular weight of 2-Methylprop-2-enylsulfonylmethylbenzene?
The molecular weight of 2-Methylprop-2-enylsulfonylmethylbenzene is 210.07 g/mol.
Where can I buy 2-Methylprop-2-enylsulfonylmethylbenzene?
You can request a quote for 2-Methylprop-2-enylsulfonylmethylbenzene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Methylprop-2-enylsulfonylmethylbenzene?
Yes, KEHONG BIO provides custom synthesis services for 2-Methylprop-2-enylsulfonylmethylbenzene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.