1,2-Bis(phenylethynyl)benzene
TL;DR: 1,2-Bis(phenylethynyl)benzene (CAS 13203-60-6) is a chemical compound with molecular formula C22H14 and molecular weight 278.10956 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1,2-bis(2-phenylethynyl)benzene
Also Known As: 1,2-bis(phenylethynyl)benzene, 1,2-bis(2-phenylethynyl)benzene, benzene, 1,2-bis(phenylethynyl)-, 1,2-Bis-phenylethynyl-benzene, 1,1'-[1,2-Phenylenedi(ethyne-2,1-diyl)]dibenzene
Application Areas
Top 5 of 9 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C22H14 |
| Molecular Weight | 278.10956 g/mol |
| XLogP | 6.0 |
| Topological Polar Surface Area (TPSA) | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 4 |
| Exact Mass | 278.10956 Da |
| Heavy Atoms | 22 |
| Complexity | 415.0 |
| SMILES | C1=CC=C(C=C1)C#CC2=CC=CC=C2C#CC3=CC=CC=C3 |
| InChIKey | XOJSMLDMLXWRMT-UHFFFAOYSA-N |
Chemical Property Profile of 1,2-Bis(phenylethynyl)benzene
Property Insights of 1,2-Bis(phenylethynyl)benzene
The XLogP value of 6.0 indicates that 1,2-Bis(phenylethynyl)benzene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 0.0 Ų, 1,2-Bis(phenylethynyl)benzene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,2-Bis(phenylethynyl)benzene has 0 hydrogen bond donor(s) and 0 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of 1,2-Bis(phenylethynyl)benzene?
The CAS number of 1,2-Bis(phenylethynyl)benzene is 13203-60-6.
What is the molecular formula of 1,2-Bis(phenylethynyl)benzene?
The molecular formula of 1,2-Bis(phenylethynyl)benzene is C22H14.
What is the molecular weight of 1,2-Bis(phenylethynyl)benzene?
The molecular weight of 1,2-Bis(phenylethynyl)benzene is 278.10956 g/mol.
Where can I buy 1,2-Bis(phenylethynyl)benzene?
You can request a quote for 1,2-Bis(phenylethynyl)benzene directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 1,2-Bis(phenylethynyl)benzene?
Yes, CoreyChem provides custom synthesis services for 1,2-Bis(phenylethynyl)benzene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.