2-Bromo-1,3-bis(methoxymethyl)benzene
TL;DR: 2-Bromo-1,3-bis(methoxymethyl)benzene (CAS 65654-53-7) is a chemical compound with molecular formula C10H13BrO2 and molecular weight 244.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-bromo-1,3-bis(methoxymethyl)benzene
Also Known As: 2-Bromo-1,3-bis(methoxymethyl)benzene, Benzene, 2-bromo-1,3-bis(methoxymethyl)-, [2,6-(CH2OMe)2C6H3]Br, RefChem:256730
| Molecular Formula | C10H13BrO2 |
|---|---|
| Molecular Weight | 244.01 g/mol |
| LogP | 1.9 |
| Topological Polar Surface Area | 18.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 244.00989 |
| Heavy Atoms | 13 |
| Complexity | 127.0 |
Chemical Identifiers
| CAS Number | 65654-53-7 |
|---|---|
| SMILES | COCC1=C(C(=CC=C1)COC)Br |
| InChIKey | BKMPHOHXSLNPRQ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-Bromo-1,3-bis(methoxymethyl)benzene (CAS 65654-53-7), with molecular formula C10H13BrO2 and molecular weight 244.01 g/mol. IUPAC: 2-bromo-1,3-bis(methoxymethyl)benzene.
Chemical Property Profile of 2-Bromo-1,3-bis(methoxymethyl)benzene
Property Insights of 2-Bromo-1,3-bis(methoxymethyl)benzene
The XLogP value of 1.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Bromo-1,3-bis(methoxymethyl)benzene. With a topological polar surface area (TPSA) of 18.5 Ų, 2-Bromo-1,3-bis(methoxymethyl)benzene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Bromo-1,3-bis(methoxymethyl)benzene 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 2-Bromo-1,3-bis(methoxymethyl)benzene?
The CAS number of 2-Bromo-1,3-bis(methoxymethyl)benzene is 65654-53-7.
What is the molecular formula of 2-Bromo-1,3-bis(methoxymethyl)benzene?
The molecular formula of 2-Bromo-1,3-bis(methoxymethyl)benzene is C10H13BrO2.
What is the molecular weight of 2-Bromo-1,3-bis(methoxymethyl)benzene?
The molecular weight of 2-Bromo-1,3-bis(methoxymethyl)benzene is 244.01 g/mol.
Where can I buy 2-Bromo-1,3-bis(methoxymethyl)benzene?
You can request a quote for 2-Bromo-1,3-bis(methoxymethyl)benzene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Bromo-1,3-bis(methoxymethyl)benzene?
Yes, KEHONG BIO provides custom synthesis services for 2-Bromo-1,3-bis(methoxymethyl)benzene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.