(E)-2-(5,5-dimethyl-3-(4-nitrostyryl)cyclohex-2-en-1-ylidene)malononitrile
TL;DR: (E)-2-(5,5-dimethyl-3-(4-nitrostyryl)cyclohex-2-en-1-ylidene)malononitrile (CAS 1141947-56-9) is a chemical compound with molecular formula C19H17N3O2 and molecular weight 319.13208 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-[5,5-dimethyl-3-[(E)-2-(4-nitrophenyl)ethenyl]cyclohex-2-en-1-ylidene]propanedinitrile
Also Known As: (E)-2-(5,5-dimethyl-3-(4-nitrostyryl)cyclohex-2-en-1-ylidene)malononitrile, (e)-2-(5,5-dimethyl-3-(4-nitrostyryl)cyclohex-2-enylidene) malononitrile, 2-[5,5-dimethyl-3-[(E)-2-(4-nitrophenyl)ethenyl]cyclohex-2-en-1-ylidene]propanedinitrile
Technical Specifications
| Molecular Formula | C19H17N3O2 |
| Molecular Weight | 319.13208 g/mol |
| XLogP | 3.9 |
| Topological Polar Surface Area (TPSA) | 93.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 319.13208 Da |
| Heavy Atoms | 24 |
| Complexity | 678.0 |
| SMILES | CC1(CC(=CC(=C(C#N)C#N)C1)/C=C/C2=CC=C(C=C2)[N+](=O)[O-])C |
| InChIKey | QIGFKZFPRJKFMF-ONEGZZNKSA-N |
Chemical Property Profile of (E)-2-(5,5-dimethyl-3-(4-nitrostyryl)cyclohex-2-en-1-ylidene)malononitrile
Property Insights of (E)-2-(5,5-dimethyl-3-(4-nitrostyryl)cyclohex-2-en-1-ylidene)malononitrile
The XLogP value of 3.9 indicates that (E)-2-(5,5-dimethyl-3-(4-nitrostyryl)cyclohex-2-en-1-ylidene)malononitrile is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 93.4 Ų falls within the moderate polarity range, balancing permeability and solubility for (E)-2-(5,5-dimethyl-3-(4-nitrostyryl)cyclohex-2-en-1-ylidene)malononitrile. Following Lipinski's Rule of Five, (E)-2-(5,5-dimethyl-3-(4-nitrostyryl)cyclohex-2-en-1-ylidene)malononitrile has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of (E)-2-(5,5-dimethyl-3-(4-nitrostyryl)cyclohex-2-en-1-ylidene)malononitrile?
The CAS number of (E)-2-(5,5-dimethyl-3-(4-nitrostyryl)cyclohex-2-en-1-ylidene)malononitrile is 1141947-56-9.
What is the molecular formula of (E)-2-(5,5-dimethyl-3-(4-nitrostyryl)cyclohex-2-en-1-ylidene)malononitrile?
The molecular formula of (E)-2-(5,5-dimethyl-3-(4-nitrostyryl)cyclohex-2-en-1-ylidene)malononitrile is C19H17N3O2.
What is the molecular weight of (E)-2-(5,5-dimethyl-3-(4-nitrostyryl)cyclohex-2-en-1-ylidene)malononitrile?
The molecular weight of (E)-2-(5,5-dimethyl-3-(4-nitrostyryl)cyclohex-2-en-1-ylidene)malononitrile is 319.13208 g/mol.
Where can I buy (E)-2-(5,5-dimethyl-3-(4-nitrostyryl)cyclohex-2-en-1-ylidene)malononitrile?
You can request a quote for (E)-2-(5,5-dimethyl-3-(4-nitrostyryl)cyclohex-2-en-1-ylidene)malononitrile directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for (E)-2-(5,5-dimethyl-3-(4-nitrostyryl)cyclohex-2-en-1-ylidene)malononitrile?
Yes, CoreyChem provides custom synthesis services for (E)-2-(5,5-dimethyl-3-(4-nitrostyryl)cyclohex-2-en-1-ylidene)malononitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.