![4-[1-(Dimethylhydrazinylidene)ethyl]benzonitrile structure](/static/products/5758/5758-03-2.webp)
4-[1-(Dimethylhydrazinylidene)ethyl]benzonitrile
TL;DR: 4-[1-(Dimethylhydrazinylidene)ethyl]benzonitrile (CAS 5758-03-2) is a chemical compound with molecular formula C11H13N3 and molecular weight 187.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[N-(dimethylamino)-C-methylcarbonimidoyl]benzonitrile
Also Known As: 4-[1-(dimethylhydrazinylidene)ethyl]benzonitrile, 4-[N-(dimethylamino)-C-methylcarbonimidoyl]benzonitrile, 4-[(Z)-N-(dimethylamino)-C-methylcarbonimidoyl]benzonitrile
| Molecular Formula | C11H13N3 |
|---|---|
| Molecular Weight | 187.11 g/mol |
| LogP | 2.1 |
| Topological Polar Surface Area | 39.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 187.11095 |
| Heavy Atoms | 14 |
| Complexity | 251.0 |
Chemical Identifiers
| CAS Number | 5758-03-2 |
|---|---|
| SMILES | CC(=NN(C)C)C1=CC=C(C=C1)C#N |
| InChIKey | AAKWREIJOLMFCX-UHFFFAOYSA-N |
Product Overview
4-[1-(Dimethylhydrazinylidene)ethyl]benzonitrile (CAS 5758-03-2), with molecular formula C11H13N3 and molecular weight 187.11 g/mol. IUPAC: 4-[N-(dimethylamino)-C-methylcarbonimidoyl]benzonitrile.
Chemical Property Profile of 4-[1-(Dimethylhydrazinylidene)ethyl]benzonitrile
Property Insights of 4-[1-(Dimethylhydrazinylidene)ethyl]benzonitrile
The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-[1-(Dimethylhydrazinylidene)ethyl]benzonitrile. With a topological polar surface area (TPSA) of 39.4 Ų, 4-[1-(Dimethylhydrazinylidene)ethyl]benzonitrile exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-[1-(Dimethylhydrazinylidene)ethyl]benzonitrile has 0 hydrogen bond donor(s) and 3 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 4-[1-(Dimethylhydrazinylidene)ethyl]benzonitrile?
The CAS number of 4-[1-(Dimethylhydrazinylidene)ethyl]benzonitrile is 5758-03-2.
What is the molecular formula of 4-[1-(Dimethylhydrazinylidene)ethyl]benzonitrile?
The molecular formula of 4-[1-(Dimethylhydrazinylidene)ethyl]benzonitrile is C11H13N3.
What is the molecular weight of 4-[1-(Dimethylhydrazinylidene)ethyl]benzonitrile?
The molecular weight of 4-[1-(Dimethylhydrazinylidene)ethyl]benzonitrile is 187.11 g/mol.
Where can I buy 4-[1-(Dimethylhydrazinylidene)ethyl]benzonitrile?
You can request a quote for 4-[1-(Dimethylhydrazinylidene)ethyl]benzonitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-[1-(Dimethylhydrazinylidene)ethyl]benzonitrile?
Yes, KEHONG BIO provides custom synthesis services for 4-[1-(Dimethylhydrazinylidene)ethyl]benzonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.