![Methyl 4-[[(2-cyanoacetyl)hydrazinylidene]methyl]benzoate structure](/static/products/340/340310-83-0.png)
Methyl 4-[[(2-cyanoacetyl)hydrazinylidene]methyl]benzoate
TL;DR: Methyl 4-[[(2-cyanoacetyl)hydrazinylidene]methyl]benzoate (CAS 340310-83-0) is a chemical compound with molecular formula C12H11N3O3 and molecular weight 245.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 4-[[(2-cyanoacetyl)hydrazinylidene]methyl]benzoate
Also Known As: methyl 4-[2-(cyanoacetyl)carbohydrazonoyl]benzoate, methyl 4-[[(2-cyanoacetyl)hydrazinylidene]methyl]benzoate
| Molecular Formula | C12H11N3O3 |
|---|---|
| Molecular Weight | 245.08 g/mol |
| LogP | 0.83698 |
| Topological Polar Surface Area | 91.55 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 245.08005 |
| Heavy Atoms | 18 |
| Complexity | 500.29407 |
Chemical Identifiers
| CAS Number | 340310-83-0 |
|---|---|
| SMILES | COC(=O)C1=CC=C(C=C1)C=NNC(=O)CC#N |
Product Overview
Methyl 4-[[(2-cyanoacetyl)hydrazinylidene]methyl]benzoate (CAS 340310-83-0), with molecular formula C12H11N3O3 and molecular weight 245.08 g/mol. IUPAC: methyl 4-[[(2-cyanoacetyl)hydrazinylidene]methyl]benzoate.
Chemical Property Profile of Methyl 4-[[(2-cyanoacetyl)hydrazinylidene]methyl]benzoate
Property Insights of Methyl 4-[[(2-cyanoacetyl)hydrazinylidene]methyl]benzoate
The XLogP value of 0.83698 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Methyl 4-[[(2-cyanoacetyl)hydrazinylidene]methyl]benzoate. The TPSA of 91.55 Ų falls within the moderate polarity range, balancing permeability and solubility for Methyl 4-[[(2-cyanoacetyl)hydrazinylidene]methyl]benzoate. Following Lipinski's Rule of Five, Methyl 4-[[(2-cyanoacetyl)hydrazinylidene]methyl]benzoate has 1 hydrogen bond donor(s) and 5 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 Methyl 4-[[(2-cyanoacetyl)hydrazinylidene]methyl]benzoate?
The CAS number of Methyl 4-[[(2-cyanoacetyl)hydrazinylidene]methyl]benzoate is 340310-83-0.
What is the molecular formula of Methyl 4-[[(2-cyanoacetyl)hydrazinylidene]methyl]benzoate?
The molecular formula of Methyl 4-[[(2-cyanoacetyl)hydrazinylidene]methyl]benzoate is C12H11N3O3.
What is the molecular weight of Methyl 4-[[(2-cyanoacetyl)hydrazinylidene]methyl]benzoate?
The molecular weight of Methyl 4-[[(2-cyanoacetyl)hydrazinylidene]methyl]benzoate is 245.08 g/mol.
Where can I buy Methyl 4-[[(2-cyanoacetyl)hydrazinylidene]methyl]benzoate?
You can request a quote for Methyl 4-[[(2-cyanoacetyl)hydrazinylidene]methyl]benzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl 4-[[(2-cyanoacetyl)hydrazinylidene]methyl]benzoate?
Yes, KEHONG BIO provides custom synthesis services for Methyl 4-[[(2-cyanoacetyl)hydrazinylidene]methyl]benzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.