(2E,4E)-3,4-dimethylhexa-2,4-dienedinitrile
TL;DR: (2E,4E)-3,4-dimethylhexa-2,4-dienedinitrile (CAS 64858-22-6) is a chemical compound with molecular formula C8H8N2 and molecular weight 132.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2E,4E)-3,4-dimethylhexa-2,4-dienedinitrile
Also Known As: 3,4-Dimethyl-2,4-hexadienedinitrile, 3,4-Dimethyl-hexadien-2,4-dinitril, 3,4-dimethylhexa-2,4-dienedinitrile, (2E,4E)-3,4-dimethylhexa-2,4-dienedinitrile, J1.863.081H
| Molecular Formula | C8H8N2 |
|---|---|
| Molecular Weight | 132.07 g/mol |
| LogP | 1.92616 |
| Topological Polar Surface Area | 47.58 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 132.06874 |
| Heavy Atoms | 10 |
| Complexity | 217.4116 |
Chemical Identifiers
| CAS Number | 64858-22-6 |
|---|---|
| SMILES | C/C(=C\C#N)/C(=C/C#N)/C |
Product Overview
(2E,4E)-3,4-dimethylhexa-2,4-dienedinitrile (CAS 64858-22-6), with molecular formula C8H8N2 and molecular weight 132.07 g/mol. IUPAC: (2E,4E)-3,4-dimethylhexa-2,4-dienedinitrile.
Chemical Property Profile of (2E,4E)-3,4-dimethylhexa-2,4-dienedinitrile
Property Insights of (2E,4E)-3,4-dimethylhexa-2,4-dienedinitrile
The XLogP value of 1.92616 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (2E,4E)-3,4-dimethylhexa-2,4-dienedinitrile. With a topological polar surface area (TPSA) of 47.58 Ų, (2E,4E)-3,4-dimethylhexa-2,4-dienedinitrile exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (2E,4E)-3,4-dimethylhexa-2,4-dienedinitrile has 0 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 (2E,4E)-3,4-dimethylhexa-2,4-dienedinitrile?
The CAS number of (2E,4E)-3,4-dimethylhexa-2,4-dienedinitrile is 64858-22-6.
What is the molecular formula of (2E,4E)-3,4-dimethylhexa-2,4-dienedinitrile?
The molecular formula of (2E,4E)-3,4-dimethylhexa-2,4-dienedinitrile is C8H8N2.
What is the molecular weight of (2E,4E)-3,4-dimethylhexa-2,4-dienedinitrile?
The molecular weight of (2E,4E)-3,4-dimethylhexa-2,4-dienedinitrile is 132.07 g/mol.
Where can I buy (2E,4E)-3,4-dimethylhexa-2,4-dienedinitrile?
You can request a quote for (2E,4E)-3,4-dimethylhexa-2,4-dienedinitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (2E,4E)-3,4-dimethylhexa-2,4-dienedinitrile?
Yes, KEHONG BIO provides custom synthesis services for (2E,4E)-3,4-dimethylhexa-2,4-dienedinitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.