![[1,1'-Biphenyl]-4-carboxylic acid, 4'-(2-methylbutyl)-, 4-cyanophenyl ester structure](/static/products/6523/65238-19-9.webp)
[1,1'-Biphenyl]-4-carboxylic acid, 4'-(2-methylbutyl)-, 4-cyanophenyl ester
TL;DR: [1,1'-Biphenyl]-4-carboxylic acid, 4'-(2-methylbutyl)-, 4-cyanophenyl ester (CAS 65238-19-9) is a chemical compound with molecular formula C25H23NO2 and molecular weight 369.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4-cyanophenyl) 4-[4-(2-methylbutyl)phenyl]benzoate
Also Known As: 4'- -4-carboxylicacid,4-cyanophenylester, 4'- - -4-carboxylicacid,4-cyanophenylester, 4-cyanophenyl 4'-(2-methylbutyl)biphenyl-4-carboxylate, J1.607.769K, [1,1'-Biphenyl]-4-carboxylic acid, 4'-(2-methylbutyl)-, 4-cyanophenyl ester
| Molecular Formula | C25H23NO2 |
|---|---|
| Molecular Weight | 369.17 g/mol |
| LogP | 6.8 |
| Topological Polar Surface Area | 50.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 7 |
| Exact Mass | 369.17288 |
| Heavy Atoms | 28 |
| Complexity | 526.0 |
Chemical Identifiers
| CAS Number | 65238-19-9 |
|---|---|
| SMILES | CCC(C)CC1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)OC3=CC=C(C=C3)C#N |
| InChIKey | KSTDUUFIIKDDDT-UHFFFAOYSA-N |
Product Overview
[1,1'-Biphenyl]-4-carboxylic acid, 4'-(2-methylbutyl)-, 4-cyanophenyl ester (CAS 65238-19-9), with molecular formula C25H23NO2 and molecular weight 369.17 g/mol. IUPAC: (4-cyanophenyl) 4-[4-(2-methylbutyl)phenyl]benzoate.
Chemical Property Profile of [1,1'-Biphenyl]-4-carboxylic acid, 4'-(2-methylbutyl)-, 4-cyanophenyl ester
Property Insights of [1,1'-Biphenyl]-4-carboxylic acid, 4'-(2-methylbutyl)-, 4-cyanophenyl ester
The XLogP value of 6.8 indicates that [1,1'-Biphenyl]-4-carboxylic acid, 4'-(2-methylbutyl)-, 4-cyanophenyl ester is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 50.1 Ų, [1,1'-Biphenyl]-4-carboxylic acid, 4'-(2-methylbutyl)-, 4-cyanophenyl ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, [1,1'-Biphenyl]-4-carboxylic acid, 4'-(2-methylbutyl)-, 4-cyanophenyl ester has 0 hydrogen bond donor(s) and 3 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'-(2-methylbutyl)-, 4-cyanophenyl ester?
The CAS number of [1,1'-Biphenyl]-4-carboxylic acid, 4'-(2-methylbutyl)-, 4-cyanophenyl ester is 65238-19-9.
What is the molecular formula of [1,1'-Biphenyl]-4-carboxylic acid, 4'-(2-methylbutyl)-, 4-cyanophenyl ester?
The molecular formula of [1,1'-Biphenyl]-4-carboxylic acid, 4'-(2-methylbutyl)-, 4-cyanophenyl ester is C25H23NO2.
What is the molecular weight of [1,1'-Biphenyl]-4-carboxylic acid, 4'-(2-methylbutyl)-, 4-cyanophenyl ester?
The molecular weight of [1,1'-Biphenyl]-4-carboxylic acid, 4'-(2-methylbutyl)-, 4-cyanophenyl ester is 369.17 g/mol.
Where can I buy [1,1'-Biphenyl]-4-carboxylic acid, 4'-(2-methylbutyl)-, 4-cyanophenyl ester?
You can request a quote for [1,1'-Biphenyl]-4-carboxylic acid, 4'-(2-methylbutyl)-, 4-cyanophenyl 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'-(2-methylbutyl)-, 4-cyanophenyl ester?
Yes, KEHONG BIO provides custom synthesis services for [1,1'-Biphenyl]-4-carboxylic acid, 4'-(2-methylbutyl)-, 4-cyanophenyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.