cis,cis-Mucononitrile
TL;DR: cis,cis-Mucononitrile (CAS 1557-59-1) is a chemical compound with molecular formula C6H4N2 and molecular weight 104.037445 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(2Z,4Z)-hexa-2,4-dienedinitrile
Also Known As: cis,cis-Mucononitrile, (2Z,4Z)-hexa-2,4-dienedinitrile, (2Z,4Z)-2,4-Hexadienedinitrile, 2,4-Hexadienedinitrile, hexa-2c,4c-dienedinitrile
Technical Specifications
| Molecular Formula | C6H4N2 |
| Molecular Weight | 104.037445 g/mol |
| XLogP | 0.6 |
| Topological Polar Surface Area (TPSA) | 47.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 104.037445 Da |
| Heavy Atoms | 8 |
| Complexity | 169.0 |
| SMILES | C(=C\C#N)\C=C/C#N |
| InChIKey | QLQYLCRMTTXKHS-CCAGOZQPSA-N |
Chemical Property Profile of cis,cis-Mucononitrile
Property Insights of cis,cis-Mucononitrile
The XLogP value of 0.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for cis,cis-Mucononitrile. With a topological polar surface area (TPSA) of 47.6 Ų, cis,cis-Mucononitrile exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, cis,cis-Mucononitrile 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
What is the CAS number of cis,cis-Mucononitrile?
The CAS number of cis,cis-Mucononitrile is 1557-59-1.
What is the molecular formula of cis,cis-Mucononitrile?
The molecular formula of cis,cis-Mucononitrile is C6H4N2.
What is the molecular weight of cis,cis-Mucononitrile?
The molecular weight of cis,cis-Mucononitrile is 104.037445 g/mol.
Where can I buy cis,cis-Mucononitrile?
You can request a quote for cis,cis-Mucononitrile directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for cis,cis-Mucononitrile?
Yes, CoreyChem provides custom synthesis services for cis,cis-Mucononitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.