1-(1,2-Dibromo-2-phenylethenyl)-4-(2-phenylethynyl)benzene
TL;DR: 1-(1,2-Dibromo-2-phenylethenyl)-4-(2-phenylethynyl)benzene (CAS 653604-05-8) is a chemical compound with molecular formula C22H14Br2 and molecular weight 435.95 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(1,2-dibromo-2-phenylethenyl)-4-(2-phenylethynyl)benzene
Also Known As: 1-(1,2-dibromo-2-phenylethenyl)-4-(2-phenylethynyl)benzene, 1-(1,2-dibromo-2-phenyl-ethenyl)-4-(2-phenylethynyl)benzene, 1-(1,2-Dibromo-2-phenylethen-1-yl)-4-(phenylethynyl)benzene, Benzene, 1-[(1E)-1,2-dibromo-2-phenylethenyl]-4-(phenylethynyl)-, Benzene,1-[(1E)-1,2-dibromo-2-phenylethenyl]-4-(phenylethynyl)
| Molecular Formula | C22H14Br2 |
|---|---|
| Molecular Weight | 435.95 g/mol |
| LogP | 6.702 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 2 |
| Exact Mass | 435.94623 |
| Heavy Atoms | 24 |
| Complexity | 896.93866 |
Chemical Identifiers
| CAS Number | 653604-05-8 |
|---|---|
| SMILES | C1=CC=C(C=C1)C#CC2=CC=C(C=C2)C(=C(C3=CC=CC=C3)Br)Br |
Product Overview
1-(1,2-Dibromo-2-phenylethenyl)-4-(2-phenylethynyl)benzene (CAS 653604-05-8), with molecular formula C22H14Br2 and molecular weight 435.95 g/mol. IUPAC: 1-(1,2-dibromo-2-phenylethenyl)-4-(2-phenylethynyl)benzene.
Chemical Property Profile of 1-(1,2-Dibromo-2-phenylethenyl)-4-(2-phenylethynyl)benzene
Property Insights of 1-(1,2-Dibromo-2-phenylethenyl)-4-(2-phenylethynyl)benzene
The XLogP value of 6.702 indicates that 1-(1,2-Dibromo-2-phenylethenyl)-4-(2-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-(1,2-Dibromo-2-phenylethenyl)-4-(2-phenylethynyl)benzene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(1,2-Dibromo-2-phenylethenyl)-4-(2-phenylethynyl)benzene has 0 hydrogen bond donor(s) and 0 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 1-(1,2-Dibromo-2-phenylethenyl)-4-(2-phenylethynyl)benzene?
The CAS number of 1-(1,2-Dibromo-2-phenylethenyl)-4-(2-phenylethynyl)benzene is 653604-05-8.
What is the molecular formula of 1-(1,2-Dibromo-2-phenylethenyl)-4-(2-phenylethynyl)benzene?
The molecular formula of 1-(1,2-Dibromo-2-phenylethenyl)-4-(2-phenylethynyl)benzene is C22H14Br2.
What is the molecular weight of 1-(1,2-Dibromo-2-phenylethenyl)-4-(2-phenylethynyl)benzene?
The molecular weight of 1-(1,2-Dibromo-2-phenylethenyl)-4-(2-phenylethynyl)benzene is 435.95 g/mol.
Where can I buy 1-(1,2-Dibromo-2-phenylethenyl)-4-(2-phenylethynyl)benzene?
You can request a quote for 1-(1,2-Dibromo-2-phenylethenyl)-4-(2-phenylethynyl)benzene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(1,2-Dibromo-2-phenylethenyl)-4-(2-phenylethynyl)benzene?
Yes, KEHONG BIO provides custom synthesis services for 1-(1,2-Dibromo-2-phenylethenyl)-4-(2-phenylethynyl)benzene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.