2-(5-Methyl-1,3-dihydrobenzimidazol-2-ylidene)-2-nitrosoacetonitrile
TL;DR: 2-(5-Methyl-1,3-dihydrobenzimidazol-2-ylidene)-2-nitrosoacetonitrile (CAS 321725-72-8) is a chemical compound with molecular formula C10H8N4O and molecular weight 200.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-hydroxyimino-2-(6-methyl-1H-benzimidazol-2-yl)acetonitrile
Also Known As: 1H-Benzimidazole-2-acetonitrile, alpha-(hydroxyimino)-5-methyl- (9CI), 2-(5-methyl-1,3-dihydrobenzimidazol-2-ylidene)-2-nitrosoacetonitrile
| Molecular Formula | C10H8N4O |
|---|---|
| Molecular Weight | 200.07 g/mol |
| LogP | 2.0 |
| Topological Polar Surface Area | 85.1 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 200.06981 |
| Heavy Atoms | 15 |
| Complexity | 319.0 |
Chemical Identifiers
| CAS Number | 321725-72-8 |
|---|---|
| SMILES | CC1=CC2=C(C=C1)N=C(N2)C(=NO)C#N |
| InChIKey | IPEUWXJGNKVUTC-UHFFFAOYSA-N |
Product Overview
2-(5-Methyl-1,3-dihydrobenzimidazol-2-ylidene)-2-nitrosoacetonitrile (CAS 321725-72-8), with molecular formula C10H8N4O and molecular weight 200.07 g/mol. IUPAC: 2-hydroxyimino-2-(6-methyl-1H-benzimidazol-2-yl)acetonitrile.
Chemical Property Profile of 2-(5-Methyl-1,3-dihydrobenzimidazol-2-ylidene)-2-nitrosoacetonitrile
Property Insights of 2-(5-Methyl-1,3-dihydrobenzimidazol-2-ylidene)-2-nitrosoacetonitrile
The XLogP value of 2.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(5-Methyl-1,3-dihydrobenzimidazol-2-ylidene)-2-nitrosoacetonitrile. The TPSA of 85.1 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(5-Methyl-1,3-dihydrobenzimidazol-2-ylidene)-2-nitrosoacetonitrile. Following Lipinski's Rule of Five, 2-(5-Methyl-1,3-dihydrobenzimidazol-2-ylidene)-2-nitrosoacetonitrile has 2 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-Methyl-1,3-dihydrobenzimidazol-2-ylidene)-2-nitrosoacetonitrile?
The CAS number of 2-(5-Methyl-1,3-dihydrobenzimidazol-2-ylidene)-2-nitrosoacetonitrile is 321725-72-8.
What is the molecular formula of 2-(5-Methyl-1,3-dihydrobenzimidazol-2-ylidene)-2-nitrosoacetonitrile?
The molecular formula of 2-(5-Methyl-1,3-dihydrobenzimidazol-2-ylidene)-2-nitrosoacetonitrile is C10H8N4O.
What is the molecular weight of 2-(5-Methyl-1,3-dihydrobenzimidazol-2-ylidene)-2-nitrosoacetonitrile?
The molecular weight of 2-(5-Methyl-1,3-dihydrobenzimidazol-2-ylidene)-2-nitrosoacetonitrile is 200.07 g/mol.
Where can I buy 2-(5-Methyl-1,3-dihydrobenzimidazol-2-ylidene)-2-nitrosoacetonitrile?
You can request a quote for 2-(5-Methyl-1,3-dihydrobenzimidazol-2-ylidene)-2-nitrosoacetonitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(5-Methyl-1,3-dihydrobenzimidazol-2-ylidene)-2-nitrosoacetonitrile?
Yes, KEHONG BIO provides custom synthesis services for 2-(5-Methyl-1,3-dihydrobenzimidazol-2-ylidene)-2-nitrosoacetonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.