Phenyl crotyl sulfone
TL;DR: Phenyl crotyl sulfone (CAS 72863-24-2) is a chemical compound with molecular formula C10H12O2S and molecular weight 196.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(E)-but-2-enyl]sulfonylbenzene
Also Known As: Phenyl crotyl sulfone, crotyl phenyl sulfone, 2-Butenylphenyl sulfone, Phenyl 2-butenyl sulfone, (2-Butenyl)phenyl sulfone
| Molecular Formula | C10H12O2S |
|---|---|
| Molecular Weight | 196.06 g/mol |
| LogP | 2.0364 |
| Topological Polar Surface Area | 34.14 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 196.0558 |
| Heavy Atoms | 13 |
| Complexity | 376.6456 |
Chemical Identifiers
| CAS Number | 72863-24-2 |
|---|---|
| SMILES | C/C=C/CS(=O)(=O)C1=CC=CC=C1 |
Product Overview
Phenyl crotyl sulfone (CAS 72863-24-2), with molecular formula C10H12O2S and molecular weight 196.06 g/mol. IUPAC: [(E)-but-2-enyl]sulfonylbenzene.
Chemical Property Profile of Phenyl crotyl sulfone
Property Insights of Phenyl crotyl sulfone
The XLogP value of 2.0364 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Phenyl crotyl sulfone. With a topological polar surface area (TPSA) of 34.14 Ų, Phenyl crotyl sulfone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Phenyl crotyl sulfone 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 Phenyl crotyl sulfone?
The CAS number of Phenyl crotyl sulfone is 72863-24-2.
What is the molecular formula of Phenyl crotyl sulfone?
The molecular formula of Phenyl crotyl sulfone is C10H12O2S.
What is the molecular weight of Phenyl crotyl sulfone?
The molecular weight of Phenyl crotyl sulfone is 196.06 g/mol.
Where can I buy Phenyl crotyl sulfone?
You can request a quote for Phenyl crotyl sulfone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Phenyl crotyl sulfone?
Yes, KEHONG BIO provides custom synthesis services for Phenyl crotyl sulfone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.