4-Acetyl-2-amino-5-methyl-3-furonitrile
TL;DR: 4-Acetyl-2-amino-5-methyl-3-furonitrile (CAS 108129-35-7) is a chemical compound with molecular formula C8H8N2O2 and molecular weight 164.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-acetyl-2-amino-5-methylfuran-3-carbonitrile
Also Known As: 4-acetyl-2-amino-5-methyl-3-furonitrile, 4-acetyl-2-amino-5-methylfuran-3-carbonitrile, 3-Furancarbonitrile,4-acetyl-2-amino-5-methyl-, ZERO/005608, 3-Furancarbonitrile, 4-acetyl-2-amino-5-methyl-
| Molecular Formula | C8H8N2O2 |
|---|---|
| Molecular Weight | 164.06 g/mol |
| LogP | 1.2445 |
| Topological Polar Surface Area | 80.02 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 164.05858 |
| Heavy Atoms | 12 |
| Complexity | 371.14496 |
Chemical Identifiers
| CAS Number | 108129-35-7 |
|---|---|
| SMILES | CC1=C(C(=C(O1)N)C#N)C(=O)C |
Product Overview
4-Acetyl-2-amino-5-methyl-3-furonitrile (CAS 108129-35-7), with molecular formula C8H8N2O2 and molecular weight 164.06 g/mol. IUPAC: 4-acetyl-2-amino-5-methylfuran-3-carbonitrile.
Chemical Property Profile of 4-Acetyl-2-amino-5-methyl-3-furonitrile
Property Insights of 4-Acetyl-2-amino-5-methyl-3-furonitrile
The XLogP value of 1.2445 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-Acetyl-2-amino-5-methyl-3-furonitrile. The TPSA of 80.02 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-Acetyl-2-amino-5-methyl-3-furonitrile. Following Lipinski's Rule of Five, 4-Acetyl-2-amino-5-methyl-3-furonitrile has 1 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-Acetyl-2-amino-5-methyl-3-furonitrile?
The CAS number of 4-Acetyl-2-amino-5-methyl-3-furonitrile is 108129-35-7.
What is the molecular formula of 4-Acetyl-2-amino-5-methyl-3-furonitrile?
The molecular formula of 4-Acetyl-2-amino-5-methyl-3-furonitrile is C8H8N2O2.
What is the molecular weight of 4-Acetyl-2-amino-5-methyl-3-furonitrile?
The molecular weight of 4-Acetyl-2-amino-5-methyl-3-furonitrile is 164.06 g/mol.
Where can I buy 4-Acetyl-2-amino-5-methyl-3-furonitrile?
You can request a quote for 4-Acetyl-2-amino-5-methyl-3-furonitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Acetyl-2-amino-5-methyl-3-furonitrile?
Yes, KEHONG BIO provides custom synthesis services for 4-Acetyl-2-amino-5-methyl-3-furonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.