1,2-Bis(chloromethyl)benzene
TL;DR: 1,2-Bis(chloromethyl)benzene (CAS 612-12-4) is a chemical compound with molecular formula C8H8Cl2 and molecular weight 174.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,2-bis(chloromethyl)benzene
Also Known As: 1,2-Bis(chloromethyl)benzene, o-Xylylene dichloride, alpha,alpha'-Dichloro-o-xylene, o-Bis(chloromethyl)benzene, o-Xylylenchlorid
| Molecular Formula | C8H8Cl2 |
|---|---|
| Molecular Weight | 174.00 g/mol |
| LogP | 2.7 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 2 |
| Exact Mass | 174.0003 |
| Heavy Atoms | 10 |
| Complexity | 81.0 |
Chemical Identifiers
| CAS Number | 612-12-4 |
|---|---|
| SMILES | C1=CC=C(C(=C1)CCl)CCl |
| InChIKey | FMGGHNGKHRCJLL-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 20 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1,2-Bis(chloromethyl)benzene (CAS 612-12-4), with molecular formula C8H8Cl2 and molecular weight 174.00 g/mol. IUPAC: 1,2-bis(chloromethyl)benzene.
Chemical Property Profile of 1,2-Bis(chloromethyl)benzene
Property Insights of 1,2-Bis(chloromethyl)benzene
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,2-Bis(chloromethyl)benzene. With a topological polar surface area (TPSA) of 0.0 Ų, 1,2-Bis(chloromethyl)benzene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,2-Bis(chloromethyl)benzene 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 1,2-Bis(chloromethyl)benzene?
The CAS number of 1,2-Bis(chloromethyl)benzene is 612-12-4.
What is the molecular formula of 1,2-Bis(chloromethyl)benzene?
The molecular formula of 1,2-Bis(chloromethyl)benzene is C8H8Cl2.
What is the molecular weight of 1,2-Bis(chloromethyl)benzene?
The molecular weight of 1,2-Bis(chloromethyl)benzene is 174.00 g/mol.
Where can I buy 1,2-Bis(chloromethyl)benzene?
You can request a quote for 1,2-Bis(chloromethyl)benzene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,2-Bis(chloromethyl)benzene?
Yes, KEHONG BIO provides custom synthesis services for 1,2-Bis(chloromethyl)benzene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.