亚糠基丙二腈
TL;DR: 亚糠基丙二腈 (CAS 3237-22-7) is a chemical compound with molecular formula C8H4N2O and molecular weight 144.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
亚糠基丙二腈
2-(furan-2-ylmethylidene)propanedinitrile
Also Known As: Furfurylidenemalononitrile, (2-Furanylmethylene)malononitrile, Furfural-malonitril, 2-Furfurylidenemalononitrile, 2-(Furan-2-ylmethylene)malononitrile
| Molecular Formula | C8H4N2O |
|---|---|
| Molecular Weight | 144.03 g/mol |
| LogP | 1.4 |
| Topological Polar Surface Area | 60.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 144.03236 |
| Heavy Atoms | 11 |
| Complexity | 244.0 |
Chemical Identifiers
| CAS Number | 3237-22-7 |
|---|---|
| SMILES | C1=COC(=C1)C=C(C#N)C#N |
| InChIKey | CRUJHLHRJSNZIU-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
亚糠基丙二腈 (CAS 3237-22-7), with molecular formula C8H4N2O and molecular weight 144.03 g/mol. IUPAC: 2-(furan-2-ylmethylidene)propanedinitrile.
Chemical Property Profile of 亚糠基丙二腈
Property Insights of 亚糠基丙二腈
The XLogP value of 1.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 亚糠基丙二腈. The TPSA of 60.7 Ų falls within the moderate polarity range, balancing permeability and solubility for 亚糠基丙二腈. Following Lipinski's Rule of Five, 亚糠基丙二腈 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 亚糠基丙二腈?
The CAS number of 亚糠基丙二腈 is 3237-22-7.
What is the molecular formula of 亚糠基丙二腈?
The molecular formula of 亚糠基丙二腈 is C8H4N2O.
What is the molecular weight of 亚糠基丙二腈?
The molecular weight of 亚糠基丙二腈 is 144.03 g/mol.
Where can I buy 亚糠基丙二腈?
You can request a quote for 亚糠基丙二腈 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 亚糠基丙二腈?
Yes, KEHONG BIO provides custom synthesis services for 亚糠基丙二腈 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.