2,4-Hexadienedinitrile, 3,4-dimethyl-, (E,Z)-
TL;DR: 2,4-Hexadienedinitrile, 3,4-dimethyl-, (E,Z)- (CAS 64858-23-7) 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.
3,4-dimethylhexa-2,4-dienedinitrile
Also Known As: 1,4-Diaethinyl-naphthalin, 3,4-dimethylhexa-2,4-dienedinitrile, 2,4-Hexadienedinitrile, 3,4-dimethyl-, (E,Z)-
| Molecular Formula | C8H8N2 |
|---|---|
| Molecular Weight | 132.07 g/mol |
| LogP | 1.8 |
| Topological Polar Surface Area | 47.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 132.06874 |
| Heavy Atoms | 10 |
| Complexity | 234.0 |
Chemical Identifiers
| CAS Number | 64858-23-7 |
|---|---|
| SMILES | CC(=CC#N)C(=CC#N)C |
| InChIKey | NVTXFMSSZHCUII-UHFFFAOYSA-N |
Product Overview
2,4-Hexadienedinitrile, 3,4-dimethyl-, (E,Z)- (CAS 64858-23-7), with molecular formula C8H8N2 and molecular weight 132.07 g/mol. IUPAC: 3,4-dimethylhexa-2,4-dienedinitrile.
Chemical Property Profile of 2,4-Hexadienedinitrile, 3,4-dimethyl-, (E,Z)-
Property Insights of 2,4-Hexadienedinitrile, 3,4-dimethyl-, (E,Z)-
The XLogP value of 1.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2,4-Hexadienedinitrile, 3,4-dimethyl-, (E,Z)-. With a topological polar surface area (TPSA) of 47.6 Ų, 2,4-Hexadienedinitrile, 3,4-dimethyl-, (E,Z)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,4-Hexadienedinitrile, 3,4-dimethyl-, (E,Z)- 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 2,4-Hexadienedinitrile, 3,4-dimethyl-, (E,Z)-?
The CAS number of 2,4-Hexadienedinitrile, 3,4-dimethyl-, (E,Z)- is 64858-23-7.
What is the molecular formula of 2,4-Hexadienedinitrile, 3,4-dimethyl-, (E,Z)-?
The molecular formula of 2,4-Hexadienedinitrile, 3,4-dimethyl-, (E,Z)- is C8H8N2.
What is the molecular weight of 2,4-Hexadienedinitrile, 3,4-dimethyl-, (E,Z)-?
The molecular weight of 2,4-Hexadienedinitrile, 3,4-dimethyl-, (E,Z)- is 132.07 g/mol.
Where can I buy 2,4-Hexadienedinitrile, 3,4-dimethyl-, (E,Z)-?
You can request a quote for 2,4-Hexadienedinitrile, 3,4-dimethyl-, (E,Z)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,4-Hexadienedinitrile, 3,4-dimethyl-, (E,Z)-?
Yes, KEHONG BIO provides custom synthesis services for 2,4-Hexadienedinitrile, 3,4-dimethyl-, (E,Z)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.