![2-[5-(N-hydroxy-C-methylcarbonimidoyl)thiophen-2-yl]acetonitrile structure](/static/products/3389/338954-38-4.webp)
2-[5-(N-hydroxy-C-methylcarbonimidoyl)thiophen-2-yl]acetonitrile
TL;DR: 2-[5-(N-hydroxy-C-methylcarbonimidoyl)thiophen-2-yl]acetonitrile (CAS 338954-38-4) is a chemical compound with molecular formula C8H8N2OS and molecular weight 180.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[5-(N-hydroxy-C-methylcarbonimidoyl)thiophen-2-yl]acetonitrile
Also Known As: 2-[5-(hydroxyethanimidoyl)-2-thienyl]acetonitrile, 2-[5-(N-hydroxy-C-methylcarbonimidoyl)thiophen-2-yl]acetonitrile
| Molecular Formula | C8H8N2OS |
|---|---|
| Molecular Weight | 180.04 g/mol |
| LogP | 2.01238 |
| Topological Polar Surface Area | 56.38 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 180.03574 |
| Heavy Atoms | 12 |
| Complexity | 335.0722 |
Chemical Identifiers
| CAS Number | 338954-38-4 |
|---|---|
| SMILES | CC(=NO)C1=CC=C(S1)CC#N |
Product Overview
2-[5-(N-hydroxy-C-methylcarbonimidoyl)thiophen-2-yl]acetonitrile (CAS 338954-38-4), with molecular formula C8H8N2OS and molecular weight 180.04 g/mol. IUPAC: 2-[5-(N-hydroxy-C-methylcarbonimidoyl)thiophen-2-yl]acetonitrile.
Chemical Property Profile of 2-[5-(N-hydroxy-C-methylcarbonimidoyl)thiophen-2-yl]acetonitrile
Property Insights of 2-[5-(N-hydroxy-C-methylcarbonimidoyl)thiophen-2-yl]acetonitrile
The XLogP value of 2.01238 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-[5-(N-hydroxy-C-methylcarbonimidoyl)thiophen-2-yl]acetonitrile. With a topological polar surface area (TPSA) of 56.38 Ų, 2-[5-(N-hydroxy-C-methylcarbonimidoyl)thiophen-2-yl]acetonitrile exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-[5-(N-hydroxy-C-methylcarbonimidoyl)thiophen-2-yl]acetonitrile 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 2-[5-(N-hydroxy-C-methylcarbonimidoyl)thiophen-2-yl]acetonitrile?
The CAS number of 2-[5-(N-hydroxy-C-methylcarbonimidoyl)thiophen-2-yl]acetonitrile is 338954-38-4.
What is the molecular formula of 2-[5-(N-hydroxy-C-methylcarbonimidoyl)thiophen-2-yl]acetonitrile?
The molecular formula of 2-[5-(N-hydroxy-C-methylcarbonimidoyl)thiophen-2-yl]acetonitrile is C8H8N2OS.
What is the molecular weight of 2-[5-(N-hydroxy-C-methylcarbonimidoyl)thiophen-2-yl]acetonitrile?
The molecular weight of 2-[5-(N-hydroxy-C-methylcarbonimidoyl)thiophen-2-yl]acetonitrile is 180.04 g/mol.
Where can I buy 2-[5-(N-hydroxy-C-methylcarbonimidoyl)thiophen-2-yl]acetonitrile?
You can request a quote for 2-[5-(N-hydroxy-C-methylcarbonimidoyl)thiophen-2-yl]acetonitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-[5-(N-hydroxy-C-methylcarbonimidoyl)thiophen-2-yl]acetonitrile?
Yes, KEHONG BIO provides custom synthesis services for 2-[5-(N-hydroxy-C-methylcarbonimidoyl)thiophen-2-yl]acetonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.