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 355.8047 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
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
Technical Specifications
| Molecular Formula | C8H7Br3O |
| Molecular Weight | 355.8047 g/mol |
| XLogP | 3.8 |
| Topological Polar Surface Area (TPSA) | 9.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 355.8047 Da |
| Heavy Atoms | 12 |
| Complexity | 130.0 |
| SMILES | COC1=CC(=C(C(=C1)Br)CBr)Br |
| InChIKey | FXHBXUVPDJMNKN-UHFFFAOYSA-N |
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 3.8 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 9.2 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
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 355.8047 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 CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 1,3-Dibromo-2-(bromomethyl)-5-methoxybenzene?
Yes, CoreyChem 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.