3,5-Bis(bromomethyl)toluene
TL;DR: 3,5-Bis(bromomethyl)toluene (CAS 19294-04-3) is a chemical compound with molecular formula C9H10Br2 and molecular weight 275.91 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,3-bis(bromomethyl)-5-methylbenzene
Also Known As: 3,5-Bis(bromomethyl)toluene, 1,3-Bis(bromomethyl)-5-methylbenzene, zlchem 903, Anastrozole Impurity 12, 3,5-bis-bromomethyltoluene
| Molecular Formula | C9H10Br2 |
|---|---|
| Molecular Weight | 275.91 g/mol |
| LogP | 3.4 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 2 |
| Exact Mass | 275.91492 |
| Heavy Atoms | 11 |
| Complexity | 102.0 |
Chemical Identifiers
| CAS Number | 19294-04-3 |
|---|---|
| SMILES | CC1=CC(=CC(=C1)CBr)CBr |
| InChIKey | AKDWRXXKHRUFMS-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3,5-Bis(bromomethyl)toluene (CAS 19294-04-3), with molecular formula C9H10Br2 and molecular weight 275.91 g/mol. IUPAC: 1,3-bis(bromomethyl)-5-methylbenzene.
Chemical Property Profile of 3,5-Bis(bromomethyl)toluene
Property Insights of 3,5-Bis(bromomethyl)toluene
The XLogP value of 3.4 indicates that 3,5-Bis(bromomethyl)toluene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 0.0 Ų, 3,5-Bis(bromomethyl)toluene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3,5-Bis(bromomethyl)toluene has 0 hydrogen bond donor(s) and 0 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 3,5-Bis(bromomethyl)toluene?
The CAS number of 3,5-Bis(bromomethyl)toluene is 19294-04-3.
What is the molecular formula of 3,5-Bis(bromomethyl)toluene?
The molecular formula of 3,5-Bis(bromomethyl)toluene is C9H10Br2.
What is the molecular weight of 3,5-Bis(bromomethyl)toluene?
The molecular weight of 3,5-Bis(bromomethyl)toluene is 275.91 g/mol.
Where can I buy 3,5-Bis(bromomethyl)toluene?
You can request a quote for 3,5-Bis(bromomethyl)toluene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3,5-Bis(bromomethyl)toluene?
Yes, KEHONG BIO provides custom synthesis services for 3,5-Bis(bromomethyl)toluene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.