1-(Bromomethyl)-4-chloro-2-(methylsulfonyl)benzene
TL;DR: 1-(Bromomethyl)-4-chloro-2-(methylsulfonyl)benzene (CAS 849035-87-6) is a chemical compound with molecular formula C8H8BrClO2S and molecular weight 281.91 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(bromomethyl)-4-chloro-2-methylsulfonylbenzene
Also Known As: 1-(Bromomethyl)-4-chloro-2-(methylsulfonyl)benzene, 3,4-Difluorophenol, 1-(bromomethyl)-4-chloro-2-(methylsulfonyl)-benzene, 1-(bromomethyl)-4-chloro-2-methylsulfonylbenzene, 4-Chloro-2-(methylsulphonyl)benzyl bromide
| Molecular Formula | C8H8BrClO2S |
|---|---|
| Molecular Weight | 281.91 g/mol |
| LogP | 2.6384 |
| Topological Polar Surface Area | 34.14 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 281.91168 |
| Heavy Atoms | 13 |
| Complexity | 414.15225 |
Chemical Identifiers
| CAS Number | 849035-87-6 |
|---|---|
| SMILES | CS(=O)(=O)C1=C(C=CC(=C1)Cl)CBr |
Product Overview
1-(Bromomethyl)-4-chloro-2-(methylsulfonyl)benzene (CAS 849035-87-6), with molecular formula C8H8BrClO2S and molecular weight 281.91 g/mol. IUPAC: 1-(bromomethyl)-4-chloro-2-methylsulfonylbenzene.
Chemical Property Profile of 1-(Bromomethyl)-4-chloro-2-(methylsulfonyl)benzene
Property Insights of 1-(Bromomethyl)-4-chloro-2-(methylsulfonyl)benzene
The XLogP value of 2.6384 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(Bromomethyl)-4-chloro-2-(methylsulfonyl)benzene. With a topological polar surface area (TPSA) of 34.14 Ų, 1-(Bromomethyl)-4-chloro-2-(methylsulfonyl)benzene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(Bromomethyl)-4-chloro-2-(methylsulfonyl)benzene 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 1-(Bromomethyl)-4-chloro-2-(methylsulfonyl)benzene?
The CAS number of 1-(Bromomethyl)-4-chloro-2-(methylsulfonyl)benzene is 849035-87-6.
What is the molecular formula of 1-(Bromomethyl)-4-chloro-2-(methylsulfonyl)benzene?
The molecular formula of 1-(Bromomethyl)-4-chloro-2-(methylsulfonyl)benzene is C8H8BrClO2S.
What is the molecular weight of 1-(Bromomethyl)-4-chloro-2-(methylsulfonyl)benzene?
The molecular weight of 1-(Bromomethyl)-4-chloro-2-(methylsulfonyl)benzene is 281.91 g/mol.
Where can I buy 1-(Bromomethyl)-4-chloro-2-(methylsulfonyl)benzene?
You can request a quote for 1-(Bromomethyl)-4-chloro-2-(methylsulfonyl)benzene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(Bromomethyl)-4-chloro-2-(methylsulfonyl)benzene?
Yes, KEHONG BIO provides custom synthesis services for 1-(Bromomethyl)-4-chloro-2-(methylsulfonyl)benzene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.