![[1,1'-Biphenyl]-4-carboxylic acid, 4'-heptyl-, 4-(2-methylbutyl)phenyl ester structure](/static/products/9275/92758-27-5.webp)
[1,1'-Biphenyl]-4-carboxylic acid, 4'-heptyl-, 4-(2-methylbutyl)phenyl ester
TL;DR: [1,1'-Biphenyl]-4-carboxylic acid, 4'-heptyl-, 4-(2-methylbutyl)phenyl ester (CAS 92758-27-5) is a chemical compound with molecular formula C31H38O2 and molecular weight 442.29 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[4-(2-methylbutyl)phenyl] 4-(4-heptylphenyl)benzoate
Also Known As: (1,1'-Biphenyl)-4-carboxylic acid, 4'-heptyl-, 4-(2-methylbutyl)phenyl ester, [1,1'-Biphenyl]-4-carboxylic acid, 4'-heptyl-, 4-(2-methylbutyl)phenyl ester, [4-(2-methylbutyl)phenyl] 4-(4-heptylphenyl)benzoate, 4-(2-Methylbutyl)phenyl 4'-heptyl[1,1'-biphenyl]-4-carboxylate, 4 -Heptylbiphenyl-4-carboxylic acid 4-(2-methylbutyl)phenyl ester
| Molecular Formula | C31H38O2 |
|---|---|
| Molecular Weight | 442.29 g/mol |
| LogP | 10.6 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 13 |
| Exact Mass | 442.28717 |
| Heavy Atoms | 33 |
| Complexity | 519.0 |
Chemical Identifiers
| CAS Number | 92758-27-5 |
|---|---|
| SMILES | CCCCCCCC1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)OC3=CC=C(C=C3)CC(C)CC |
| InChIKey | OFPKTMNHQRPVJW-UHFFFAOYSA-N |
Product Overview
[1,1'-Biphenyl]-4-carboxylic acid, 4'-heptyl-, 4-(2-methylbutyl)phenyl ester (CAS 92758-27-5), with molecular formula C31H38O2 and molecular weight 442.29 g/mol. IUPAC: [4-(2-methylbutyl)phenyl] 4-(4-heptylphenyl)benzoate.
Chemical Property Profile of [1,1'-Biphenyl]-4-carboxylic acid, 4'-heptyl-, 4-(2-methylbutyl)phenyl ester
Property Insights of [1,1'-Biphenyl]-4-carboxylic acid, 4'-heptyl-, 4-(2-methylbutyl)phenyl ester
The XLogP value of 10.6 indicates that [1,1'-Biphenyl]-4-carboxylic acid, 4'-heptyl-, 4-(2-methylbutyl)phenyl ester is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 26.3 Ų, [1,1'-Biphenyl]-4-carboxylic acid, 4'-heptyl-, 4-(2-methylbutyl)phenyl ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, [1,1'-Biphenyl]-4-carboxylic acid, 4'-heptyl-, 4-(2-methylbutyl)phenyl ester 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 [1,1'-Biphenyl]-4-carboxylic acid, 4'-heptyl-, 4-(2-methylbutyl)phenyl ester?
The CAS number of [1,1'-Biphenyl]-4-carboxylic acid, 4'-heptyl-, 4-(2-methylbutyl)phenyl ester is 92758-27-5.
What is the molecular formula of [1,1'-Biphenyl]-4-carboxylic acid, 4'-heptyl-, 4-(2-methylbutyl)phenyl ester?
The molecular formula of [1,1'-Biphenyl]-4-carboxylic acid, 4'-heptyl-, 4-(2-methylbutyl)phenyl ester is C31H38O2.
What is the molecular weight of [1,1'-Biphenyl]-4-carboxylic acid, 4'-heptyl-, 4-(2-methylbutyl)phenyl ester?
The molecular weight of [1,1'-Biphenyl]-4-carboxylic acid, 4'-heptyl-, 4-(2-methylbutyl)phenyl ester is 442.29 g/mol.
Where can I buy [1,1'-Biphenyl]-4-carboxylic acid, 4'-heptyl-, 4-(2-methylbutyl)phenyl ester?
You can request a quote for [1,1'-Biphenyl]-4-carboxylic acid, 4'-heptyl-, 4-(2-methylbutyl)phenyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for [1,1'-Biphenyl]-4-carboxylic acid, 4'-heptyl-, 4-(2-methylbutyl)phenyl ester?
Yes, KEHONG BIO provides custom synthesis services for [1,1'-Biphenyl]-4-carboxylic acid, 4'-heptyl-, 4-(2-methylbutyl)phenyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.