2-(Phenylethynyl)benzaldehyde
TL;DR: 2-(Phenylethynyl)benzaldehyde (CAS 59046-72-9) is a chemical compound with molecular formula C15H10O and molecular weight 206.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(2-phenylethynyl)benzaldehyde
Also Known As: 2-(phenylethynyl)benzaldehyde, 2-(2-phenylethynyl)benzaldehyde, 2-PHENYLETHYNYL-BENZALDEHYDE, 2-Phenylethyny-Benzaldehyde, 2-Phenylethynylbenzaldehyde
| Molecular Formula | C15H10O |
|---|---|
| Molecular Weight | 206.07 g/mol |
| LogP | 2.8989 |
| Topological Polar Surface Area | 17.07 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 206.07317 |
| Heavy Atoms | 16 |
| Complexity | 544.39276 |
Chemical Identifiers
| CAS Number | 59046-72-9 |
|---|---|
| SMILES | C1=CC=C(C=C1)C#CC2=CC=CC=C2C=O |
Product Overview
2-(Phenylethynyl)benzaldehyde (CAS 59046-72-9), with molecular formula C15H10O and molecular weight 206.07 g/mol. IUPAC: 2-(2-phenylethynyl)benzaldehyde.
Chemical Property Profile of 2-(Phenylethynyl)benzaldehyde
Property Insights of 2-(Phenylethynyl)benzaldehyde
The XLogP value of 2.8989 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(Phenylethynyl)benzaldehyde. With a topological polar surface area (TPSA) of 17.07 Ų, 2-(Phenylethynyl)benzaldehyde exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(Phenylethynyl)benzaldehyde has 0 hydrogen bond donor(s) and 1 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-(Phenylethynyl)benzaldehyde?
The CAS number of 2-(Phenylethynyl)benzaldehyde is 59046-72-9.
What is the molecular formula of 2-(Phenylethynyl)benzaldehyde?
The molecular formula of 2-(Phenylethynyl)benzaldehyde is C15H10O.
What is the molecular weight of 2-(Phenylethynyl)benzaldehyde?
The molecular weight of 2-(Phenylethynyl)benzaldehyde is 206.07 g/mol.
Where can I buy 2-(Phenylethynyl)benzaldehyde?
You can request a quote for 2-(Phenylethynyl)benzaldehyde directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(Phenylethynyl)benzaldehyde?
Yes, KEHONG BIO provides custom synthesis services for 2-(Phenylethynyl)benzaldehyde and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.