![[[4-[Cyano(phenyl)methylidene]cyclohexa-2,5-dien-1-ylidene]amino] acetate structure](/static/products/7354/735-48-8.webp)
[[4-[Cyano(phenyl)methylidene]cyclohexa-2,5-dien-1-ylidene]amino] acetate
TL;DR: [[4-[Cyano(phenyl)methylidene]cyclohexa-2,5-dien-1-ylidene]amino] acetate (CAS 735-48-8) is a chemical compound with molecular formula C16H12N2O2 and molecular weight 264.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[[4-[cyano(phenyl)methylidene]cyclohexa-2,5-dien-1-ylidene]amino] acetate
Also Known As: [[4-[cyano(phenyl)methylidene]cyclohexa-2,5-dien-1-ylidene]amino] acetate|[[4-[cyano(phenyl)methylidene]cyclohexa-2,5-dien-1-ylidene]a|2,.alpha.)-acetonitrile, 4-oxo-.alpha.-phenyl-, O-acetyloxime|2,5-Cyclohexadiene-.delta.(1,.alpha.)-acetonitrile, 4-oxo-.alpha.-phenyl-, O-acetyloxime|(2Z)-{(4Z)-4-[(Acetyloxy)imino]cyclohexa-2,5-dien-1-ylidene}(phenyl)acetonitrile|[[4-[cyano(phenyl)methylidene]cyclohexa-2,5-dien-1-ylidene]amino] ethanoate|acetic acid [[4-[cyano(phenyl)methylene]cyclohexa-2,5-dien-1-ylidene]amino] ester|acetic acid [[4-[cyano(phenyl)methylidene]-1-cyclohexa-2,5-dienylidene]amino] ester|MLS003389355|SMR002049010|cid_352429
| Molecular Formula | C16H12N2O2 |
|---|---|
| Molecular Weight | 264.09 g/mol |
| LogP | 2.6 |
| Topological Polar Surface Area | 62.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 264.08987 |
| Heavy Atoms | 20 |
| Complexity | 534.0 |
Chemical Identifiers
| CAS Number | 735-48-8 |
|---|---|
| SMILES | CC(=O)ON=C1C=CC(=C(C#N)C2=CC=CC=C2)C=C1 |
| InChIKey | LCPOATCJCJOUDL-UHFFFAOYSA-N |
Product Overview
[[4-[Cyano(phenyl)methylidene]cyclohexa-2,5-dien-1-ylidene]amino] acetate (CAS 735-48-8), with molecular formula C16H12N2O2 and molecular weight 264.09 g/mol. IUPAC: [[4-[cyano(phenyl)methylidene]cyclohexa-2,5-dien-1-ylidene]amino] acetate.
Chemical Property Profile of [[4-[Cyano(phenyl)methylidene]cyclohexa-2,5-dien-1-ylidene]amino] acetate
Property Insights of [[4-[Cyano(phenyl)methylidene]cyclohexa-2,5-dien-1-ylidene]amino] acetate
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for [[4-[Cyano(phenyl)methylidene]cyclohexa-2,5-dien-1-ylidene]amino] acetate. The TPSA of 62.5 Ų falls within the moderate polarity range, balancing permeability and solubility for [[4-[Cyano(phenyl)methylidene]cyclohexa-2,5-dien-1-ylidene]amino] acetate. Following Lipinski's Rule of Five, [[4-[Cyano(phenyl)methylidene]cyclohexa-2,5-dien-1-ylidene]amino] acetate 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
Frequently Asked Questions
What is the CAS number of [[4-[Cyano(phenyl)methylidene]cyclohexa-2,5-dien-1-ylidene]amino] acetate?
The CAS number of [[4-[Cyano(phenyl)methylidene]cyclohexa-2,5-dien-1-ylidene]amino] acetate is 735-48-8.
What is the molecular formula of [[4-[Cyano(phenyl)methylidene]cyclohexa-2,5-dien-1-ylidene]amino] acetate?
The molecular formula of [[4-[Cyano(phenyl)methylidene]cyclohexa-2,5-dien-1-ylidene]amino] acetate is C16H12N2O2.
What is the molecular weight of [[4-[Cyano(phenyl)methylidene]cyclohexa-2,5-dien-1-ylidene]amino] acetate?
The molecular weight of [[4-[Cyano(phenyl)methylidene]cyclohexa-2,5-dien-1-ylidene]amino] acetate is 264.09 g/mol.
Where can I buy [[4-[Cyano(phenyl)methylidene]cyclohexa-2,5-dien-1-ylidene]amino] acetate?
You can request a quote for [[4-[Cyano(phenyl)methylidene]cyclohexa-2,5-dien-1-ylidene]amino] acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for [[4-[Cyano(phenyl)methylidene]cyclohexa-2,5-dien-1-ylidene]amino] acetate?
Yes, KEHONG BIO provides custom synthesis services for [[4-[Cyano(phenyl)methylidene]cyclohexa-2,5-dien-1-ylidene]amino] acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.