6-Bromo-7-(chloromethyl)-2,3-dihydro-1,4-benzodioxine
TL;DR: 6-Bromo-7-(chloromethyl)-2,3-dihydro-1,4-benzodioxine (CAS 792954-07-5) is a chemical compound with molecular formula C9H8BrClO2 and molecular weight 261.94 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-bromo-7-(chloromethyl)-2,3-dihydro-1,4-benzodioxine
Also Known As: 6-bromo-7-(chloromethyl)-2,3-dihydro-1,4-benzodioxine, 818-997-3, RefChem:541099
| Molecular Formula | C9H8BrClO2 |
|---|---|
| Molecular Weight | 261.94 g/mol |
| LogP | 2.9591 |
| Topological Polar Surface Area | 18.46 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 261.9396 |
| Heavy Atoms | 13 |
| Complexity | 327.6359 |
Chemical Identifiers
| CAS Number | 792954-07-5 |
|---|---|
| SMILES | C1COC2=C(O1)C=C(C(=C2)Br)CCl |
Product Overview
6-Bromo-7-(chloromethyl)-2,3-dihydro-1,4-benzodioxine (CAS 792954-07-5), with molecular formula C9H8BrClO2 and molecular weight 261.94 g/mol. IUPAC: 6-bromo-7-(chloromethyl)-2,3-dihydro-1,4-benzodioxine.
Chemical Property Profile of 6-Bromo-7-(chloromethyl)-2,3-dihydro-1,4-benzodioxine
Property Insights of 6-Bromo-7-(chloromethyl)-2,3-dihydro-1,4-benzodioxine
The XLogP value of 2.9591 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 6-Bromo-7-(chloromethyl)-2,3-dihydro-1,4-benzodioxine. With a topological polar surface area (TPSA) of 18.46 Ų, 6-Bromo-7-(chloromethyl)-2,3-dihydro-1,4-benzodioxine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 6-Bromo-7-(chloromethyl)-2,3-dihydro-1,4-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-Bromo-7-(chloromethyl)-2,3-dihydro-1,4-benzodioxine?
The CAS number of 6-Bromo-7-(chloromethyl)-2,3-dihydro-1,4-benzodioxine is 792954-07-5.
What is the molecular formula of 6-Bromo-7-(chloromethyl)-2,3-dihydro-1,4-benzodioxine?
The molecular formula of 6-Bromo-7-(chloromethyl)-2,3-dihydro-1,4-benzodioxine is C9H8BrClO2.
What is the molecular weight of 6-Bromo-7-(chloromethyl)-2,3-dihydro-1,4-benzodioxine?
The molecular weight of 6-Bromo-7-(chloromethyl)-2,3-dihydro-1,4-benzodioxine is 261.94 g/mol.
Where can I buy 6-Bromo-7-(chloromethyl)-2,3-dihydro-1,4-benzodioxine?
You can request a quote for 6-Bromo-7-(chloromethyl)-2,3-dihydro-1,4-benzodioxine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-Bromo-7-(chloromethyl)-2,3-dihydro-1,4-benzodioxine?
Yes, KEHONG BIO provides custom synthesis services for 6-Bromo-7-(chloromethyl)-2,3-dihydro-1,4-benzodioxine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.