氰基丙烯酸乙酯
TL;DR: 氰基丙烯酸乙酯 (CAS 7085-85-0) is a chemical compound with molecular formula C6H7NO2 and molecular weight 125.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
氰基丙烯酸乙酯
ethyl 2-cyanoprop-2-enoate
Also Known As: Ethyl 2-cyanoacrylate, Ethyl cyanoacrylate, ethyl 2-cyanoprop-2-enoate, Cyacrin, Krazy glue
| Molecular Formula | C6H7NO2 |
|---|---|
| Molecular Weight | 125.05 g/mol |
| LogP | 1.0 |
| Topological Polar Surface Area | 50.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 125.047676 |
| Heavy Atoms | 9 |
| Complexity | 175.0 |
| Melting Point | -20 to -25 °C |
| Boiling Point | 55 °C at 3 mm Hg |
| Density | 1.040 at 20 °C |
| Solubility | Soluble in methyl ethyl ketone, toluene, acetone, DMF /N,N-dimethylformamide/, nitromethane |
| Flash Point | 82.78 °C (closed cup) |
| Vapor Pressure | VP: <0.27 kPa at 25 °C |
| Refractive Index | 1.4391 at 20 °C |
Chemical Identifiers
| CAS Number | 7085-85-0 |
|---|---|
| SMILES | CCOC(=O)C(=C)C#N |
| InChIKey | FGBJXOREULPLGL-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 20 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
氰基丙烯酸乙酯 (CAS 7085-85-0), with molecular formula C6H7NO2 and molecular weight 125.05 g/mol. IUPAC: ethyl 2-cyanoprop-2-enoate.
Chemical Property Profile of 氰基丙烯酸乙酯
Property Insights of 氰基丙烯酸乙酯
The XLogP value of 1.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 氰基丙烯酸乙酯. With a topological polar surface area (TPSA) of 50.1 Ų, 氰基丙烯酸乙酯 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 氰基丙烯酸乙酯 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 氰基丙烯酸乙酯?
The CAS number of 氰基丙烯酸乙酯 is 7085-85-0.
What is the molecular formula of 氰基丙烯酸乙酯?
The molecular formula of 氰基丙烯酸乙酯 is C6H7NO2.
What is the molecular weight of 氰基丙烯酸乙酯?
The molecular weight of 氰基丙烯酸乙酯 is 125.05 g/mol.
Where can I buy 氰基丙烯酸乙酯?
You can request a quote for 氰基丙烯酸乙酯 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 氰基丙烯酸乙酯?
Yes, KEHONG BIO provides custom synthesis services for 氰基丙烯酸乙酯 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.