2-(Bromomethyl)-1,3,4-trichlorobenzene
TL;DR: 2-(Bromomethyl)-1,3,4-trichlorobenzene (CAS 4960-48-9) is a chemical compound with molecular formula C7H4BrCl3 and molecular weight 271.86 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(bromomethyl)-1,3,4-trichlorobenzene
Also Known As: 2-(Bromomethyl)-1,3,4-trichlorobenzene, 2,3,6-trichlorobenzyl bromide, C(Br)c1c(Cl)ccc(Cl)c1Cl, 225-602-2, EINECS 225-602-2
| Molecular Formula | C7H4BrCl3 |
|---|---|
| Molecular Weight | 271.86 g/mol |
| LogP | 4.3 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 1 |
| Exact Mass | 271.8562 |
| Heavy Atoms | 11 |
| Complexity | 131.0 |
Chemical Identifiers
| CAS Number | 4960-48-9 |
|---|---|
| SMILES | C1=CC(=C(C(=C1Cl)CBr)Cl)Cl |
| InChIKey | URKUOLGHTOGYJL-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-(Bromomethyl)-1,3,4-trichlorobenzene (CAS 4960-48-9), with molecular formula C7H4BrCl3 and molecular weight 271.86 g/mol. IUPAC: 2-(bromomethyl)-1,3,4-trichlorobenzene.
Chemical Property Profile of 2-(Bromomethyl)-1,3,4-trichlorobenzene
Property Insights of 2-(Bromomethyl)-1,3,4-trichlorobenzene
The XLogP value of 4.3 indicates that 2-(Bromomethyl)-1,3,4-trichlorobenzene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 0.0 Ų, 2-(Bromomethyl)-1,3,4-trichlorobenzene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(Bromomethyl)-1,3,4-trichlorobenzene 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 2-(Bromomethyl)-1,3,4-trichlorobenzene?
The CAS number of 2-(Bromomethyl)-1,3,4-trichlorobenzene is 4960-48-9.
What is the molecular formula of 2-(Bromomethyl)-1,3,4-trichlorobenzene?
The molecular formula of 2-(Bromomethyl)-1,3,4-trichlorobenzene is C7H4BrCl3.
What is the molecular weight of 2-(Bromomethyl)-1,3,4-trichlorobenzene?
The molecular weight of 2-(Bromomethyl)-1,3,4-trichlorobenzene is 271.86 g/mol.
Where can I buy 2-(Bromomethyl)-1,3,4-trichlorobenzene?
You can request a quote for 2-(Bromomethyl)-1,3,4-trichlorobenzene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(Bromomethyl)-1,3,4-trichlorobenzene?
Yes, KEHONG BIO provides custom synthesis services for 2-(Bromomethyl)-1,3,4-trichlorobenzene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.