2,4-Bis(chloromethyl)toluene
TL;DR: 2,4-Bis(chloromethyl)toluene (CAS 2735-05-9) is a chemical compound with molecular formula C9H10Cl2 and molecular weight 188.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,4-bis(chloromethyl)-1-methylbenzene
Also Known As: 2,4-Bis(chloromethyl)toluene, di(Chloromethyl)toluene, 2,4-bis toluene, Di(chloromethyl) toluene, 2,4-Bis(chloromethyl)-1-methylbenzene
| Molecular Formula | C9H10Cl2 |
|---|---|
| Molecular Weight | 188.02 g/mol |
| LogP | 3.1 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 2 |
| Exact Mass | 188.01596 |
| Heavy Atoms | 11 |
| Complexity | 114.0 |
Chemical Identifiers
| CAS Number | 2735-05-9 |
|---|---|
| SMILES | CC1=C(C=C(C=C1)CCl)CCl |
| InChIKey | HKCWYAWNOIYUAS-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2,4-Bis(chloromethyl)toluene (CAS 2735-05-9), with molecular formula C9H10Cl2 and molecular weight 188.02 g/mol. IUPAC: 2,4-bis(chloromethyl)-1-methylbenzene.
Chemical Property Profile of 2,4-Bis(chloromethyl)toluene
Property Insights of 2,4-Bis(chloromethyl)toluene
The XLogP value of 3.1 indicates that 2,4-Bis(chloromethyl)toluene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 0.0 Ų, 2,4-Bis(chloromethyl)toluene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,4-Bis(chloromethyl)toluene 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 2,4-Bis(chloromethyl)toluene?
The CAS number of 2,4-Bis(chloromethyl)toluene is 2735-05-9.
What is the molecular formula of 2,4-Bis(chloromethyl)toluene?
The molecular formula of 2,4-Bis(chloromethyl)toluene is C9H10Cl2.
What is the molecular weight of 2,4-Bis(chloromethyl)toluene?
The molecular weight of 2,4-Bis(chloromethyl)toluene is 188.02 g/mol.
Where can I buy 2,4-Bis(chloromethyl)toluene?
You can request a quote for 2,4-Bis(chloromethyl)toluene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,4-Bis(chloromethyl)toluene?
Yes, KEHONG BIO provides custom synthesis services for 2,4-Bis(chloromethyl)toluene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.