(1,1'-Biphenyl)-4-carboxylic acid, 4'-pentyl-, 4-pentylphenyl ester
TL;DR: (1,1'-Biphenyl)-4-carboxylic acid, 4'-pentyl-, 4-pentylphenyl ester (CAS 59748-19-5) is a chemical compound with molecular formula C29H34O2 and molecular weight 414.2559 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(4-pentylphenyl) 4-(4-pentylphenyl)benzoate
Also Known As: 4-Pentylphenyl 4-pentyl-4'-biphenylcarboxylate, 4-Pentylphenyl 4'-pentyl[1,1'-biphenyl]-4-carboxylate, [1,1'-Biphenyl]-4-carboxylic acid, 4'-pentyl-, 4-pentylphenyl ester, (4-pentylphenyl) 4-(4-pentylphenyl)benzoate, 4-Pentylphenyl 4'-pentyl(1,1'-biphenyl)-4-carboxylate
Application Areas
Top 5 of 2 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C29H34O2 |
| Molecular Weight | 414.2559 g/mol |
| XLogP | 9.8 |
| Topological Polar Surface Area (TPSA) | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 12 |
| Exact Mass | 414.2559 Da |
| Heavy Atoms | 31 |
| Complexity | 477.0 |
| SMILES | CCCCCC1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)OC3=CC=C(C=C3)CCCCC |
| InChIKey | HYRFINJDWFLMME-UHFFFAOYSA-N |
Chemical Property Profile of (1,1'-Biphenyl)-4-carboxylic acid, 4'-pentyl-, 4-pentylphenyl ester
Property Insights of (1,1'-Biphenyl)-4-carboxylic acid, 4'-pentyl-, 4-pentylphenyl ester
The XLogP value of 9.8 indicates that (1,1'-Biphenyl)-4-carboxylic acid, 4'-pentyl-, 4-pentylphenyl 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'-pentyl-, 4-pentylphenyl ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (1,1'-Biphenyl)-4-carboxylic acid, 4'-pentyl-, 4-pentylphenyl ester has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of (1,1'-Biphenyl)-4-carboxylic acid, 4'-pentyl-, 4-pentylphenyl ester?
The CAS number of (1,1'-Biphenyl)-4-carboxylic acid, 4'-pentyl-, 4-pentylphenyl ester is 59748-19-5.
What is the molecular formula of (1,1'-Biphenyl)-4-carboxylic acid, 4'-pentyl-, 4-pentylphenyl ester?
The molecular formula of (1,1'-Biphenyl)-4-carboxylic acid, 4'-pentyl-, 4-pentylphenyl ester is C29H34O2.
What is the molecular weight of (1,1'-Biphenyl)-4-carboxylic acid, 4'-pentyl-, 4-pentylphenyl ester?
The molecular weight of (1,1'-Biphenyl)-4-carboxylic acid, 4'-pentyl-, 4-pentylphenyl ester is 414.2559 g/mol.
Where can I buy (1,1'-Biphenyl)-4-carboxylic acid, 4'-pentyl-, 4-pentylphenyl ester?
You can request a quote for (1,1'-Biphenyl)-4-carboxylic acid, 4'-pentyl-, 4-pentylphenyl ester directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for (1,1'-Biphenyl)-4-carboxylic acid, 4'-pentyl-, 4-pentylphenyl ester?
Yes, CoreyChem provides custom synthesis services for (1,1'-Biphenyl)-4-carboxylic acid, 4'-pentyl-, 4-pentylphenyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.