6-Chloro-8-(chloromethyl)-2,4-dihydro-1,3-benzodioxine
TL;DR: 6-Chloro-8-(chloromethyl)-2,4-dihydro-1,3-benzodioxine (CAS 175136-61-5) is a chemical compound with molecular formula C9H8Cl2O2 and molecular weight 217.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-chloro-8-(chloromethyl)-4H-1,3-benzodioxine
Also Known As: 6-chloro-8-(chloromethyl)-4H-1,3-benzodioxine, 4H-1,3-Benzodioxin, 6-chloro-8-(chloromethyl)-, 6-Chloro-8-(chloromethyl)-4H-benzo[d][1,3]dioxine, 6-chloro-8-(chloromethyl)benzo-1,3-dioxan, 6-chloro-8-(chloromethyl)-2,4-dihydro-1,3-benzodioxine
| Molecular Formula | C9H8Cl2O2 |
|---|---|
| Molecular Weight | 217.99 g/mol |
| LogP | 2.9453 |
| Topological Polar Surface Area | 18.46 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 217.99013 |
| Heavy Atoms | 13 |
| Complexity | 308.3859 |
Chemical Identifiers
| CAS Number | 175136-61-5 |
|---|---|
| SMILES | C1C2=C(C(=CC(=C2)Cl)CCl)OCO1 |
Product Overview
6-Chloro-8-(chloromethyl)-2,4-dihydro-1,3-benzodioxine (CAS 175136-61-5), with molecular formula C9H8Cl2O2 and molecular weight 217.99 g/mol. IUPAC: 6-chloro-8-(chloromethyl)-4H-1,3-benzodioxine.
Chemical Property Profile of 6-Chloro-8-(chloromethyl)-2,4-dihydro-1,3-benzodioxine
Property Insights of 6-Chloro-8-(chloromethyl)-2,4-dihydro-1,3-benzodioxine
The XLogP value of 2.9453 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 6-Chloro-8-(chloromethyl)-2,4-dihydro-1,3-benzodioxine. With a topological polar surface area (TPSA) of 18.46 Ų, 6-Chloro-8-(chloromethyl)-2,4-dihydro-1,3-benzodioxine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 6-Chloro-8-(chloromethyl)-2,4-dihydro-1,3-benzodioxine 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 6-Chloro-8-(chloromethyl)-2,4-dihydro-1,3-benzodioxine?
The CAS number of 6-Chloro-8-(chloromethyl)-2,4-dihydro-1,3-benzodioxine is 175136-61-5.
What is the molecular formula of 6-Chloro-8-(chloromethyl)-2,4-dihydro-1,3-benzodioxine?
The molecular formula of 6-Chloro-8-(chloromethyl)-2,4-dihydro-1,3-benzodioxine is C9H8Cl2O2.
What is the molecular weight of 6-Chloro-8-(chloromethyl)-2,4-dihydro-1,3-benzodioxine?
The molecular weight of 6-Chloro-8-(chloromethyl)-2,4-dihydro-1,3-benzodioxine is 217.99 g/mol.
Where can I buy 6-Chloro-8-(chloromethyl)-2,4-dihydro-1,3-benzodioxine?
You can request a quote for 6-Chloro-8-(chloromethyl)-2,4-dihydro-1,3-benzodioxine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-Chloro-8-(chloromethyl)-2,4-dihydro-1,3-benzodioxine?
Yes, KEHONG BIO provides custom synthesis services for 6-Chloro-8-(chloromethyl)-2,4-dihydro-1,3-benzodioxine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.