Bis(3,4-dimethylbenzyl)sulfone
TL;DR: Bis(3,4-dimethylbenzyl)sulfone (CAS 34277-83-3) is a chemical compound with molecular formula C18H22O2S and molecular weight 302.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[(3,4-dimethylphenyl)methylsulfonylmethyl]-1,2-dimethylbenzene
Also Known As: Bis[3,4-dimethylbenzyl]sulfone, 3,4-Dimethylphenylmethylsulfone, Bis(3,4-dimethylbenzyl)sulfone, 1,1'-[Sulfonylbis(methylene)]bis(3,4-dimethylbenzene), 4-([(3,4-Dimethylbenzyl)sulfonyl]methyl)-1,2-dimethylbenzene #
| Molecular Formula | C18H22O2S |
|---|---|
| Molecular Weight | 302.13 g/mol |
| LogP | 4.0 |
| Topological Polar Surface Area | 42.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 302.13406 |
| Heavy Atoms | 21 |
| Complexity | 389.0 |
Chemical Identifiers
| CAS Number | 34277-83-3 |
|---|---|
| SMILES | CC1=C(C=C(C=C1)CS(=O)(=O)CC2=CC(=C(C=C2)C)C)C |
| InChIKey | MFEDSGWROYASKV-UHFFFAOYSA-N |
Product Overview
Bis(3,4-dimethylbenzyl)sulfone (CAS 34277-83-3), with molecular formula C18H22O2S and molecular weight 302.13 g/mol. IUPAC: 4-[(3,4-dimethylphenyl)methylsulfonylmethyl]-1,2-dimethylbenzene.
Chemical Property Profile of Bis(3,4-dimethylbenzyl)sulfone
Property Insights of Bis(3,4-dimethylbenzyl)sulfone
The XLogP value of 4.0 indicates that Bis(3,4-dimethylbenzyl)sulfone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 42.5 Ų, Bis(3,4-dimethylbenzyl)sulfone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Bis(3,4-dimethylbenzyl)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 Bis(3,4-dimethylbenzyl)sulfone?
The CAS number of Bis(3,4-dimethylbenzyl)sulfone is 34277-83-3.
What is the molecular formula of Bis(3,4-dimethylbenzyl)sulfone?
The molecular formula of Bis(3,4-dimethylbenzyl)sulfone is C18H22O2S.
What is the molecular weight of Bis(3,4-dimethylbenzyl)sulfone?
The molecular weight of Bis(3,4-dimethylbenzyl)sulfone is 302.13 g/mol.
Where can I buy Bis(3,4-dimethylbenzyl)sulfone?
You can request a quote for Bis(3,4-dimethylbenzyl)sulfone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Bis(3,4-dimethylbenzyl)sulfone?
Yes, KEHONG BIO provides custom synthesis services for Bis(3,4-dimethylbenzyl)sulfone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.