Benzene, 1-(chloromethyl)-4-(3-chloropropyl)-
TL;DR: Benzene, 1-(chloromethyl)-4-(3-chloropropyl)- (CAS 69156-39-4) is a chemical compound with molecular formula C10H12Cl2 and molecular weight 202.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(chloromethyl)-4-(3-chloropropyl)benzene
Also Known As: 1-(chloromethyl)-4-(3-chloropropyl)benzene, Benzene, 1-(chloromethyl)-4-(3-chloropropyl)-, 4-<3-Chlor-propyl>-benzylchlorid, 4-(3-Chloropropyl)benzyl chloride, 1-(4-chloromethylphenyl)3-chloropropane
| Molecular Formula | C10H12Cl2 |
|---|---|
| Molecular Weight | 202.03 g/mol |
| LogP | 3.5 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 4 |
| Exact Mass | 202.0316 |
| Heavy Atoms | 12 |
| Complexity | 106.0 |
Chemical Identifiers
| CAS Number | 69156-39-4 |
|---|---|
| SMILES | C1=CC(=CC=C1CCCCl)CCl |
| InChIKey | QKHASKRXLOXBFY-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Benzene, 1-(chloromethyl)-4-(3-chloropropyl)- (CAS 69156-39-4), with molecular formula C10H12Cl2 and molecular weight 202.03 g/mol. IUPAC: 1-(chloromethyl)-4-(3-chloropropyl)benzene.
Chemical Property Profile of Benzene, 1-(chloromethyl)-4-(3-chloropropyl)-
Property Insights of Benzene, 1-(chloromethyl)-4-(3-chloropropyl)-
The XLogP value of 3.5 indicates that Benzene, 1-(chloromethyl)-4-(3-chloropropyl)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 0.0 Ų, Benzene, 1-(chloromethyl)-4-(3-chloropropyl)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Benzene, 1-(chloromethyl)-4-(3-chloropropyl)- 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 Benzene, 1-(chloromethyl)-4-(3-chloropropyl)-?
The CAS number of Benzene, 1-(chloromethyl)-4-(3-chloropropyl)- is 69156-39-4.
What is the molecular formula of Benzene, 1-(chloromethyl)-4-(3-chloropropyl)-?
The molecular formula of Benzene, 1-(chloromethyl)-4-(3-chloropropyl)- is C10H12Cl2.
What is the molecular weight of Benzene, 1-(chloromethyl)-4-(3-chloropropyl)-?
The molecular weight of Benzene, 1-(chloromethyl)-4-(3-chloropropyl)- is 202.03 g/mol.
Where can I buy Benzene, 1-(chloromethyl)-4-(3-chloropropyl)-?
You can request a quote for Benzene, 1-(chloromethyl)-4-(3-chloropropyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzene, 1-(chloromethyl)-4-(3-chloropropyl)-?
Yes, KEHONG BIO provides custom synthesis services for Benzene, 1-(chloromethyl)-4-(3-chloropropyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.