2-Methyl-4-(4-methylphenyl)phenyl 2-bromobenzoate
TL;DR: 2-Methyl-4-(4-methylphenyl)phenyl 2-bromobenzoate (CAS 301208-75-3) is a chemical compound with molecular formula C21H17BrO2 and molecular weight 380.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2-methyl-4-(4-methylphenyl)phenyl] 2-bromobenzoate
Also Known As: BAS 00120989, 3,4'-dimethylbiphenyl-4-yl 2-bromobenzoate, 2-methyl-4-(4-methylphenyl)phenyl 2-bromobenzoate, [2-methyl-4-(4-methylphenyl)phenyl] 2-bromobenzoate, 3,4'-dimethyl[1,1'-biphenyl]-4-yl 2-bromobenzoate
| Molecular Formula | C21H17BrO2 |
|---|---|
| Molecular Weight | 380.04 g/mol |
| LogP | 5.95214 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 380.0412 |
| Heavy Atoms | 24 |
| Complexity | 882.5955 |
Chemical Identifiers
| CAS Number | 301208-75-3 |
|---|---|
| SMILES | CC1=CC=C(C=C1)C2=CC(=C(C=C2)OC(=O)C3=CC=CC=C3Br)C |
Product Overview
2-Methyl-4-(4-methylphenyl)phenyl 2-bromobenzoate (CAS 301208-75-3), with molecular formula C21H17BrO2 and molecular weight 380.04 g/mol. IUPAC: [2-methyl-4-(4-methylphenyl)phenyl] 2-bromobenzoate.
Chemical Property Profile of 2-Methyl-4-(4-methylphenyl)phenyl 2-bromobenzoate
Property Insights of 2-Methyl-4-(4-methylphenyl)phenyl 2-bromobenzoate
The XLogP value of 5.95214 indicates that 2-Methyl-4-(4-methylphenyl)phenyl 2-bromobenzoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 26.3 Ų, 2-Methyl-4-(4-methylphenyl)phenyl 2-bromobenzoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Methyl-4-(4-methylphenyl)phenyl 2-bromobenzoate 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 2-Methyl-4-(4-methylphenyl)phenyl 2-bromobenzoate?
The CAS number of 2-Methyl-4-(4-methylphenyl)phenyl 2-bromobenzoate is 301208-75-3.
What is the molecular formula of 2-Methyl-4-(4-methylphenyl)phenyl 2-bromobenzoate?
The molecular formula of 2-Methyl-4-(4-methylphenyl)phenyl 2-bromobenzoate is C21H17BrO2.
What is the molecular weight of 2-Methyl-4-(4-methylphenyl)phenyl 2-bromobenzoate?
The molecular weight of 2-Methyl-4-(4-methylphenyl)phenyl 2-bromobenzoate is 380.04 g/mol.
Where can I buy 2-Methyl-4-(4-methylphenyl)phenyl 2-bromobenzoate?
You can request a quote for 2-Methyl-4-(4-methylphenyl)phenyl 2-bromobenzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Methyl-4-(4-methylphenyl)phenyl 2-bromobenzoate?
Yes, KEHONG BIO provides custom synthesis services for 2-Methyl-4-(4-methylphenyl)phenyl 2-bromobenzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.