(1,1'-联苯)-3-甲酸
TL;DR: (1,1'-联苯)-3-甲酸 (CAS 716-76-7) is a chemical compound with molecular formula C13H10O2 and molecular weight 198.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(1,1'-联苯)-3-甲酸
3-phenylbenzoic acid
Also Known As: Biphenyl-3-carboxylic acid, 3-phenylbenzoic acid, 3-BIPHENYLCARBOXYLIC ACID, [1,1'-Biphenyl]-3-carboxylic acid, Diphenyl-3-carboxylic acid
| Molecular Formula | C13H10O2 |
|---|---|
| Molecular Weight | 198.07 g/mol |
| LogP | 3.5 |
| Topological Polar Surface Area | 37.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 198.06808 |
| Heavy Atoms | 15 |
| Complexity | 219.0 |
Chemical Identifiers
| CAS Number | 716-76-7 |
|---|---|
| SMILES | C1=CC=C(C=C1)C2=CC(=CC=C2)C(=O)O |
| InChIKey | XNLWJFYYOIRPIO-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 15 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
(1,1'-联苯)-3-甲酸 (CAS 716-76-7), with molecular formula C13H10O2 and molecular weight 198.07 g/mol. IUPAC: 3-phenylbenzoic acid.
Chemical Property Profile of (1,1'-联苯)-3-甲酸
Property Insights of (1,1'-联苯)-3-甲酸
The XLogP value of 3.5 indicates that (1,1'-联苯)-3-甲酸 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 37.3 Ų, (1,1'-联苯)-3-甲酸 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (1,1'-联苯)-3-甲酸 has 1 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of (1,1'-联苯)-3-甲酸?
The CAS number of (1,1'-联苯)-3-甲酸 is 716-76-7.
What is the molecular formula of (1,1'-联苯)-3-甲酸?
The molecular formula of (1,1'-联苯)-3-甲酸 is C13H10O2.
What is the molecular weight of (1,1'-联苯)-3-甲酸?
The molecular weight of (1,1'-联苯)-3-甲酸 is 198.07 g/mol.
Where can I buy (1,1'-联苯)-3-甲酸?
You can request a quote for (1,1'-联苯)-3-甲酸 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (1,1'-联苯)-3-甲酸?
Yes, KEHONG BIO provides custom synthesis services for (1,1'-联苯)-3-甲酸 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.