1,3-Dibromo-2-(bromomethyl)-5-methoxybenzene
TL;DR: 1,3-Dibromo-2-(bromomethyl)-5-methoxybenzene (CAS 130445-13-5) is a chemical compound with molecular formula C8H7Br3O and molecular weight 355.80 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,3-dibromo-2-(bromomethyl)-5-methoxybenzene
Also Known As: 1,3-dibromo-2-(bromomethyl)-5-methoxybenzene, 2,6-Dibromo-4-methoxy-benzyl bromide, 2-bromomethyl-1,3-dibromo-5-methoxy-benzene, 1,3-dibromo-2-(bromomethyl)-5-methoxy-benzene
| Molecular Formula | C8H7Br3O |
|---|---|
| Molecular Weight | 355.80 g/mol |
| LogP | 4.1151 |
| Topological Polar Surface Area | 9.23 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 355.8047 |
| Heavy Atoms | 12 |
| Complexity | 262.62662 |
Chemical Identifiers
| CAS Number | 130445-13-5 |
|---|---|
| SMILES | COC1=CC(=C(C(=C1)Br)CBr)Br |
Product Overview
1,3-Dibromo-2-(bromomethyl)-5-methoxybenzene (CAS 130445-13-5), with molecular formula C8H7Br3O and molecular weight 355.80 g/mol. IUPAC: 1,3-dibromo-2-(bromomethyl)-5-methoxybenzene.
Chemical Property Profile of 1,3-Dibromo-2-(bromomethyl)-5-methoxybenzene
Property Insights of 1,3-Dibromo-2-(bromomethyl)-5-methoxybenzene
The XLogP value of 4.1151 indicates that 1,3-Dibromo-2-(bromomethyl)-5-methoxybenzene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 9.23 Ų, 1,3-Dibromo-2-(bromomethyl)-5-methoxybenzene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,3-Dibromo-2-(bromomethyl)-5-methoxybenzene has 0 hydrogen bond donor(s) and 1 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 1,3-Dibromo-2-(bromomethyl)-5-methoxybenzene?
The CAS number of 1,3-Dibromo-2-(bromomethyl)-5-methoxybenzene is 130445-13-5.
What is the molecular formula of 1,3-Dibromo-2-(bromomethyl)-5-methoxybenzene?
The molecular formula of 1,3-Dibromo-2-(bromomethyl)-5-methoxybenzene is C8H7Br3O.
What is the molecular weight of 1,3-Dibromo-2-(bromomethyl)-5-methoxybenzene?
The molecular weight of 1,3-Dibromo-2-(bromomethyl)-5-methoxybenzene is 355.80 g/mol.
Where can I buy 1,3-Dibromo-2-(bromomethyl)-5-methoxybenzene?
You can request a quote for 1,3-Dibromo-2-(bromomethyl)-5-methoxybenzene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,3-Dibromo-2-(bromomethyl)-5-methoxybenzene?
Yes, KEHONG BIO provides custom synthesis services for 1,3-Dibromo-2-(bromomethyl)-5-methoxybenzene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.