m-Xylyl chloride
TL;DR: m-Xylyl chloride (CAS 620-19-9) is a chemical compound with molecular formula C8H9Cl and molecular weight 140.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(chloromethyl)-3-methylbenzene
Also Known As: 3-Methylbenzyl chloride, 1-(chloromethyl)-3-methylbenzene, m-Xylyl chloride, m-Methylbenzyl chloride, 3-Methylbenzylchloride
| Molecular Formula | C8H9Cl |
|---|---|
| Molecular Weight | 140.04 g/mol |
| LogP | 2.9 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 1 |
| Exact Mass | 140.03928 |
| Heavy Atoms | 9 |
| Complexity | 80.0 |
Chemical Identifiers
| CAS Number | 620-19-9 |
|---|---|
| SMILES | CC1=CC(=CC=C1)CCl |
| InChIKey | LZBOHNCMCCSTJX-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 15 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
m-Xylyl chloride (CAS 620-19-9), with molecular formula C8H9Cl and molecular weight 140.04 g/mol. IUPAC: 1-(chloromethyl)-3-methylbenzene.
Chemical Property Profile of m-Xylyl chloride
Property Insights of m-Xylyl chloride
The XLogP value of 2.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for m-Xylyl chloride. With a topological polar surface area (TPSA) of 0.0 Ų, m-Xylyl chloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, m-Xylyl chloride has 0 hydrogen bond donor(s) and 0 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 m-Xylyl chloride?
The CAS number of m-Xylyl chloride is 620-19-9.
What is the molecular formula of m-Xylyl chloride?
The molecular formula of m-Xylyl chloride is C8H9Cl.
What is the molecular weight of m-Xylyl chloride?
The molecular weight of m-Xylyl chloride is 140.04 g/mol.
Where can I buy m-Xylyl chloride?
You can request a quote for m-Xylyl chloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for m-Xylyl chloride?
Yes, KEHONG BIO provides custom synthesis services for m-Xylyl chloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.