2,6-Bis(3,4-dichlorophenyl)-4-methyl-5-phenyl-2-heptenedinitrile
TL;DR: 2,6-Bis(3,4-dichlorophenyl)-4-methyl-5-phenyl-2-heptenedinitrile (CAS 128350-00-5) is a chemical compound with molecular formula C26H18Cl4N2 and molecular weight 498.0224 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2,6-bis(3,4-dichlorophenyl)-4-methyl-5-phenylhept-2-enedinitrile
Also Known As: 2,6-Bis(3,4-dichlorophenyl)-4-methyl-5-phenyl-2-heptenedinitrile, 2-HEPTENEDINITRILE, 2,6-BIS(3,4-DICHLOROPHENYL)-4-METHYL-5-PHENYL-
Technical Specifications
| Molecular Formula | C26H18Cl4N2 |
| Molecular Weight | 498.0224 g/mol |
| XLogP | 8.3 |
| Topological Polar Surface Area (TPSA) | 47.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 6 |
| Exact Mass | 498.0224 Da |
| Heavy Atoms | 32 |
| Complexity | 743.0 |
| SMILES | CC(C=C(C#N)C1=CC(=C(C=C1)Cl)Cl)C(C2=CC=CC=C2)C(C#N)C3=CC(=C(C=C3)Cl)Cl |
| InChIKey | DUWOIFQHJVNIOF-UHFFFAOYSA-N |
Chemical Property Profile of 2,6-Bis(3,4-dichlorophenyl)-4-methyl-5-phenyl-2-heptenedinitrile
Property Insights of 2,6-Bis(3,4-dichlorophenyl)-4-methyl-5-phenyl-2-heptenedinitrile
The XLogP value of 8.3 indicates that 2,6-Bis(3,4-dichlorophenyl)-4-methyl-5-phenyl-2-heptenedinitrile is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 47.6 Ų, 2,6-Bis(3,4-dichlorophenyl)-4-methyl-5-phenyl-2-heptenedinitrile exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,6-Bis(3,4-dichlorophenyl)-4-methyl-5-phenyl-2-heptenedinitrile has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of 2,6-Bis(3,4-dichlorophenyl)-4-methyl-5-phenyl-2-heptenedinitrile?
The CAS number of 2,6-Bis(3,4-dichlorophenyl)-4-methyl-5-phenyl-2-heptenedinitrile is 128350-00-5.
What is the molecular formula of 2,6-Bis(3,4-dichlorophenyl)-4-methyl-5-phenyl-2-heptenedinitrile?
The molecular formula of 2,6-Bis(3,4-dichlorophenyl)-4-methyl-5-phenyl-2-heptenedinitrile is C26H18Cl4N2.
What is the molecular weight of 2,6-Bis(3,4-dichlorophenyl)-4-methyl-5-phenyl-2-heptenedinitrile?
The molecular weight of 2,6-Bis(3,4-dichlorophenyl)-4-methyl-5-phenyl-2-heptenedinitrile is 498.0224 g/mol.
Where can I buy 2,6-Bis(3,4-dichlorophenyl)-4-methyl-5-phenyl-2-heptenedinitrile?
You can request a quote for 2,6-Bis(3,4-dichlorophenyl)-4-methyl-5-phenyl-2-heptenedinitrile directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 2,6-Bis(3,4-dichlorophenyl)-4-methyl-5-phenyl-2-heptenedinitrile?
Yes, CoreyChem provides custom synthesis services for 2,6-Bis(3,4-dichlorophenyl)-4-methyl-5-phenyl-2-heptenedinitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.