Propan-2-yl biphenyl-2-carboxylate
TL;DR: Propan-2-yl biphenyl-2-carboxylate (CAS 65936-11-0) is a chemical compound with molecular formula C16H16O2 and molecular weight 240.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
propan-2-yl 2-phenylbenzoate
Also Known As: propan-2-yl biphenyl-2-carboxylate, propan-2-yl 2-phenylbenzoate, propan-2-yl [1,1'-biphenyl]-2-carboxylate, Biphenyl-2-carboxylic acid isopropyl ester, J2.458.761D
| Molecular Formula | C16H16O2 |
|---|---|
| Molecular Weight | 240.12 g/mol |
| LogP | 4.0 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 240.11504 |
| Heavy Atoms | 18 |
| Complexity | 266.0 |
Chemical Identifiers
| CAS Number | 65936-11-0 |
|---|---|
| SMILES | CC(C)OC(=O)C1=CC=CC=C1C2=CC=CC=C2 |
| InChIKey | MCPBZXXXEOFTPD-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Propan-2-yl biphenyl-2-carboxylate (CAS 65936-11-0), with molecular formula C16H16O2 and molecular weight 240.12 g/mol. IUPAC: propan-2-yl 2-phenylbenzoate.
Chemical Property Profile of Propan-2-yl biphenyl-2-carboxylate
Property Insights of Propan-2-yl biphenyl-2-carboxylate
The XLogP value of 4.0 indicates that Propan-2-yl biphenyl-2-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, Propan-2-yl biphenyl-2-carboxylate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Propan-2-yl biphenyl-2-carboxylate has 0 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 Propan-2-yl biphenyl-2-carboxylate?
The CAS number of Propan-2-yl biphenyl-2-carboxylate is 65936-11-0.
What is the molecular formula of Propan-2-yl biphenyl-2-carboxylate?
The molecular formula of Propan-2-yl biphenyl-2-carboxylate is C16H16O2.
What is the molecular weight of Propan-2-yl biphenyl-2-carboxylate?
The molecular weight of Propan-2-yl biphenyl-2-carboxylate is 240.12 g/mol.
Where can I buy Propan-2-yl biphenyl-2-carboxylate?
You can request a quote for Propan-2-yl biphenyl-2-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Propan-2-yl biphenyl-2-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for Propan-2-yl biphenyl-2-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.