(3,4-Dichlorophenyl)methyl 3-bromo-4-methylbenzoate
TL;DR: (3,4-Dichlorophenyl)methyl 3-bromo-4-methylbenzoate (CAS 650596-11-5) is a chemical compound with molecular formula C15H11BrCl2O2 and molecular weight 371.93 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(3,4-dichlorophenyl)methyl 3-bromo-4-methylbenzoate
Also Known As: 3,4-dichlorobenzyl 3-bromo-4-methylbenzoate, (3,4-dichlorophenyl)methyl 3-bromo-4-methylbenzoate
| Molecular Formula | C15H11BrCl2O2 |
|---|---|
| Molecular Weight | 371.93 g/mol |
| LogP | 5.42132 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 371.93195 |
| Heavy Atoms | 20 |
| Complexity | 656.31696 |
Chemical Identifiers
| CAS Number | 650596-11-5 |
|---|---|
| SMILES | CC1=C(C=C(C=C1)C(=O)OCC2=CC(=C(C=C2)Cl)Cl)Br |
Product Overview
(3,4-Dichlorophenyl)methyl 3-bromo-4-methylbenzoate (CAS 650596-11-5), with molecular formula C15H11BrCl2O2 and molecular weight 371.93 g/mol. IUPAC: (3,4-dichlorophenyl)methyl 3-bromo-4-methylbenzoate.
Chemical Property Profile of (3,4-Dichlorophenyl)methyl 3-bromo-4-methylbenzoate
Property Insights of (3,4-Dichlorophenyl)methyl 3-bromo-4-methylbenzoate
The XLogP value of 5.42132 indicates that (3,4-Dichlorophenyl)methyl 3-bromo-4-methylbenzoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 26.3 Ų, (3,4-Dichlorophenyl)methyl 3-bromo-4-methylbenzoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (3,4-Dichlorophenyl)methyl 3-bromo-4-methylbenzoate has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of (3,4-Dichlorophenyl)methyl 3-bromo-4-methylbenzoate?
The CAS number of (3,4-Dichlorophenyl)methyl 3-bromo-4-methylbenzoate is 650596-11-5.
What is the molecular formula of (3,4-Dichlorophenyl)methyl 3-bromo-4-methylbenzoate?
The molecular formula of (3,4-Dichlorophenyl)methyl 3-bromo-4-methylbenzoate is C15H11BrCl2O2.
What is the molecular weight of (3,4-Dichlorophenyl)methyl 3-bromo-4-methylbenzoate?
The molecular weight of (3,4-Dichlorophenyl)methyl 3-bromo-4-methylbenzoate is 371.93 g/mol.
Where can I buy (3,4-Dichlorophenyl)methyl 3-bromo-4-methylbenzoate?
You can request a quote for (3,4-Dichlorophenyl)methyl 3-bromo-4-methylbenzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (3,4-Dichlorophenyl)methyl 3-bromo-4-methylbenzoate?
Yes, KEHONG BIO provides custom synthesis services for (3,4-Dichlorophenyl)methyl 3-bromo-4-methylbenzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.