2-Cyano-3,3-diphenyl-2-propenoic acid
TL;DR: 2-Cyano-3,3-diphenyl-2-propenoic acid (CAS 10380-41-3) is a chemical compound with molecular formula C16H11NO2 and molecular weight 249.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-cyano-3,3-diphenylprop-2-enoic acid
Also Known As: 2-cyano-3,3-diphenylacrylic acid, 2-Cyano-3,3-diphenylpropenoic acid, 2-cyano-3,3-diphenylprop-2-enoic acid, 3,3-diphenyl-2-cyanoacrylic acid, 2-cyano-3,3-diphenylacrylicacid
| Molecular Formula | C16H11NO2 |
|---|---|
| Molecular Weight | 249.08 g/mol |
| LogP | 3.09668 |
| Topological Polar Surface Area | 61.09 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 249.07898 |
| Heavy Atoms | 19 |
| Complexity | 610.6532 |
Chemical Identifiers
| CAS Number | 10380-41-3 |
|---|---|
| SMILES | C1=CC=C(C=C1)C(=C(C#N)C(=O)O)C2=CC=CC=C2 |
Product Overview
2-Cyano-3,3-diphenyl-2-propenoic acid (CAS 10380-41-3), with molecular formula C16H11NO2 and molecular weight 249.08 g/mol. IUPAC: 2-cyano-3,3-diphenylprop-2-enoic acid.
Chemical Property Profile of 2-Cyano-3,3-diphenyl-2-propenoic acid
Property Insights of 2-Cyano-3,3-diphenyl-2-propenoic acid
The XLogP value of 3.09668 indicates that 2-Cyano-3,3-diphenyl-2-propenoic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 61.09 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Cyano-3,3-diphenyl-2-propenoic acid. Following Lipinski's Rule of Five, 2-Cyano-3,3-diphenyl-2-propenoic acid 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 2-Cyano-3,3-diphenyl-2-propenoic acid?
The CAS number of 2-Cyano-3,3-diphenyl-2-propenoic acid is 10380-41-3.
What is the molecular formula of 2-Cyano-3,3-diphenyl-2-propenoic acid?
The molecular formula of 2-Cyano-3,3-diphenyl-2-propenoic acid is C16H11NO2.
What is the molecular weight of 2-Cyano-3,3-diphenyl-2-propenoic acid?
The molecular weight of 2-Cyano-3,3-diphenyl-2-propenoic acid is 249.08 g/mol.
Where can I buy 2-Cyano-3,3-diphenyl-2-propenoic acid?
You can request a quote for 2-Cyano-3,3-diphenyl-2-propenoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Cyano-3,3-diphenyl-2-propenoic acid?
Yes, KEHONG BIO provides custom synthesis services for 2-Cyano-3,3-diphenyl-2-propenoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.