![2-(2-Methylbutyl)phenyl 4'-octyl[1,1'-biphenyl]-4-carboxylate structure](/static/products/6642/66424-45-1.webp)
2-(2-Methylbutyl)phenyl 4'-octyl[1,1'-biphenyl]-4-carboxylate
TL;DR: 2-(2-Methylbutyl)phenyl 4'-octyl[1,1'-biphenyl]-4-carboxylate (CAS 66424-45-1) is a chemical compound with molecular formula C32H40O2 and molecular weight 456.30 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2-[(2R)-2-methylbutyl]phenyl] 4-(4-octylphenyl)benzoate
Also Known As: (1,1'-Biphenyl)-4-carboxylic acid, 4'-octyl-, 4-(2-methylbutyl)phenyl ester, [2-[(2R)-2-methylbutyl]phenyl] 4-(4-octylphenyl)benzoate, 2-(2-Methylbutyl)phenyl 4'-octyl[1,1'-biphenyl]-4-carboxylate, 2-[(2R)-2-Methylbutyl]phenyl 4'-octyl[1,1'-biphenyl]-4-carboxylate, [1,1'-Biphenyl]-4-carboxylic acid, 4'-octyl-, 4-(2-methylbutyl)phenyl ester
| Molecular Formula | C32H40O2 |
|---|---|
| Molecular Weight | 456.30 g/mol |
| LogP | 9.0644 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 13 |
| Exact Mass | 456.30283 |
| Heavy Atoms | 34 |
| Complexity | 1001.94183 |
Chemical Identifiers
| CAS Number | 66424-45-1 |
|---|---|
| SMILES | CCCCCCCCC1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)OC3=CC=CC=C3C[C@H](C)CC |
Product Overview
2-(2-Methylbutyl)phenyl 4'-octyl[1,1'-biphenyl]-4-carboxylate (CAS 66424-45-1), with molecular formula C32H40O2 and molecular weight 456.30 g/mol. IUPAC: [2-[(2R)-2-methylbutyl]phenyl] 4-(4-octylphenyl)benzoate.
Chemical Property Profile of 2-(2-Methylbutyl)phenyl 4'-octyl[1,1'-biphenyl]-4-carboxylate
Property Insights of 2-(2-Methylbutyl)phenyl 4'-octyl[1,1'-biphenyl]-4-carboxylate
The XLogP value of 9.0644 indicates that 2-(2-Methylbutyl)phenyl 4'-octyl[1,1'-biphenyl]-4-carboxylate 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-(2-Methylbutyl)phenyl 4'-octyl[1,1'-biphenyl]-4-carboxylate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(2-Methylbutyl)phenyl 4'-octyl[1,1'-biphenyl]-4-carboxylate 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-(2-Methylbutyl)phenyl 4'-octyl[1,1'-biphenyl]-4-carboxylate?
The CAS number of 2-(2-Methylbutyl)phenyl 4'-octyl[1,1'-biphenyl]-4-carboxylate is 66424-45-1.
What is the molecular formula of 2-(2-Methylbutyl)phenyl 4'-octyl[1,1'-biphenyl]-4-carboxylate?
The molecular formula of 2-(2-Methylbutyl)phenyl 4'-octyl[1,1'-biphenyl]-4-carboxylate is C32H40O2.
What is the molecular weight of 2-(2-Methylbutyl)phenyl 4'-octyl[1,1'-biphenyl]-4-carboxylate?
The molecular weight of 2-(2-Methylbutyl)phenyl 4'-octyl[1,1'-biphenyl]-4-carboxylate is 456.30 g/mol.
Where can I buy 2-(2-Methylbutyl)phenyl 4'-octyl[1,1'-biphenyl]-4-carboxylate?
You can request a quote for 2-(2-Methylbutyl)phenyl 4'-octyl[1,1'-biphenyl]-4-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(2-Methylbutyl)phenyl 4'-octyl[1,1'-biphenyl]-4-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for 2-(2-Methylbutyl)phenyl 4'-octyl[1,1'-biphenyl]-4-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.