![[1-(7-Bicyclo[4.2.0]octa-1,3,5-trienyl)ethylideneamino] acetate structure](/static/products/6813/6813-93-0.webp)
[1-(7-Bicyclo[4.2.0]octa-1,3,5-trienyl)ethylideneamino] acetate
TL;DR: [1-(7-Bicyclo[4.2.0]octa-1,3,5-trienyl)ethylideneamino] acetate (CAS 6813-93-0) is a chemical compound with molecular formula C12H13NO2 and molecular weight 203.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[1-(7-bicyclo[4.2.0]octa-1,3,5-trienyl)ethylideneamino] acetate
Also Known As: Ethanone,1-bicyclo4.2.0octa-1,3,5-trien-7-yl-,O-acetyloxime, [(Z)-1-(7-bicyclo[4.2.0]octa-1,3,5-trienyl)ethylideneamino] acetate
| Molecular Formula | C12H13NO2 |
|---|---|
| Molecular Weight | 203.09 g/mol |
| LogP | 1.5 |
| Topological Polar Surface Area | 38.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 203.09464 |
| Heavy Atoms | 15 |
| Complexity | 285.0 |
Chemical Identifiers
| CAS Number | 6813-93-0 |
|---|---|
| SMILES | CC(=NOC(=O)C)C1CC2=CC=CC=C12 |
| InChIKey | SAOFVFOSJVBALO-UHFFFAOYSA-N |
Product Overview
[1-(7-Bicyclo[4.2.0]octa-1,3,5-trienyl)ethylideneamino] acetate (CAS 6813-93-0), with molecular formula C12H13NO2 and molecular weight 203.09 g/mol. IUPAC: [1-(7-bicyclo[4.2.0]octa-1,3,5-trienyl)ethylideneamino] acetate.
Chemical Property Profile of [1-(7-Bicyclo[4.2.0]octa-1,3,5-trienyl)ethylideneamino] acetate
Property Insights of [1-(7-Bicyclo[4.2.0]octa-1,3,5-trienyl)ethylideneamino] acetate
The XLogP value of 1.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for [1-(7-Bicyclo[4.2.0]octa-1,3,5-trienyl)ethylideneamino] acetate. With a topological polar surface area (TPSA) of 38.7 Ų, [1-(7-Bicyclo[4.2.0]octa-1,3,5-trienyl)ethylideneamino] acetate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, [1-(7-Bicyclo[4.2.0]octa-1,3,5-trienyl)ethylideneamino] acetate 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 [1-(7-Bicyclo[4.2.0]octa-1,3,5-trienyl)ethylideneamino] acetate?
The CAS number of [1-(7-Bicyclo[4.2.0]octa-1,3,5-trienyl)ethylideneamino] acetate is 6813-93-0.
What is the molecular formula of [1-(7-Bicyclo[4.2.0]octa-1,3,5-trienyl)ethylideneamino] acetate?
The molecular formula of [1-(7-Bicyclo[4.2.0]octa-1,3,5-trienyl)ethylideneamino] acetate is C12H13NO2.
What is the molecular weight of [1-(7-Bicyclo[4.2.0]octa-1,3,5-trienyl)ethylideneamino] acetate?
The molecular weight of [1-(7-Bicyclo[4.2.0]octa-1,3,5-trienyl)ethylideneamino] acetate is 203.09 g/mol.
Where can I buy [1-(7-Bicyclo[4.2.0]octa-1,3,5-trienyl)ethylideneamino] acetate?
You can request a quote for [1-(7-Bicyclo[4.2.0]octa-1,3,5-trienyl)ethylideneamino] acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for [1-(7-Bicyclo[4.2.0]octa-1,3,5-trienyl)ethylideneamino] acetate?
Yes, KEHONG BIO provides custom synthesis services for [1-(7-Bicyclo[4.2.0]octa-1,3,5-trienyl)ethylideneamino] acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.