(3Z)-3-(dimethylaminomethylidene)-5-(2-nitroethenyl)furan-2-one
TL;DR: (3Z)-3-(dimethylaminomethylidene)-5-(2-nitroethenyl)furan-2-one (CAS 169827-98-9) is a chemical compound with molecular formula C9H10N2O4 and molecular weight 210.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(3Z)-3-(dimethylaminomethylidene)-5-(2-nitroethenyl)furan-2-one
| Molecular Formula | C9H10N2O4 |
|---|---|
| Molecular Weight | 210.06 g/mol |
| LogP | 0.663 |
| Topological Polar Surface Area | 72.68 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 210.06406 |
| Heavy Atoms | 15 |
| Complexity | 379.57358 |
Chemical Identifiers
| CAS Number | 169827-98-9 |
|---|---|
| SMILES | CN(C)/C=C\1/C=C(OC1=O)C=C[N+](=O)[O-] |
Product Overview
(3Z)-3-(dimethylaminomethylidene)-5-(2-nitroethenyl)furan-2-one (CAS 169827-98-9), with molecular formula C9H10N2O4 and molecular weight 210.06 g/mol. IUPAC: (3Z)-3-(dimethylaminomethylidene)-5-(2-nitroethenyl)furan-2-one.
Chemical Property Profile of (3Z)-3-(dimethylaminomethylidene)-5-(2-nitroethenyl)furan-2-one
Property Insights of (3Z)-3-(dimethylaminomethylidene)-5-(2-nitroethenyl)furan-2-one
The XLogP value of 0.663 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (3Z)-3-(dimethylaminomethylidene)-5-(2-nitroethenyl)furan-2-one. The TPSA of 72.68 Ų falls within the moderate polarity range, balancing permeability and solubility for (3Z)-3-(dimethylaminomethylidene)-5-(2-nitroethenyl)furan-2-one. Following Lipinski's Rule of Five, (3Z)-3-(dimethylaminomethylidene)-5-(2-nitroethenyl)furan-2-one has 0 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 (3Z)-3-(dimethylaminomethylidene)-5-(2-nitroethenyl)furan-2-one?
The CAS number of (3Z)-3-(dimethylaminomethylidene)-5-(2-nitroethenyl)furan-2-one is 169827-98-9.
What is the molecular formula of (3Z)-3-(dimethylaminomethylidene)-5-(2-nitroethenyl)furan-2-one?
The molecular formula of (3Z)-3-(dimethylaminomethylidene)-5-(2-nitroethenyl)furan-2-one is C9H10N2O4.
What is the molecular weight of (3Z)-3-(dimethylaminomethylidene)-5-(2-nitroethenyl)furan-2-one?
The molecular weight of (3Z)-3-(dimethylaminomethylidene)-5-(2-nitroethenyl)furan-2-one is 210.06 g/mol.
Where can I buy (3Z)-3-(dimethylaminomethylidene)-5-(2-nitroethenyl)furan-2-one?
You can request a quote for (3Z)-3-(dimethylaminomethylidene)-5-(2-nitroethenyl)furan-2-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (3Z)-3-(dimethylaminomethylidene)-5-(2-nitroethenyl)furan-2-one?
Yes, KEHONG BIO provides custom synthesis services for (3Z)-3-(dimethylaminomethylidene)-5-(2-nitroethenyl)furan-2-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.