2-(1H-Benzo[d]imidazol-2(3H)-ylidene)malononitrile
TL;DR: 2-(1H-Benzo[d]imidazol-2(3H)-ylidene)malononitrile (CAS 4933-40-8) is a chemical compound with molecular formula C10H6N4 and molecular weight 182.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(1,3-dihydrobenzimidazol-2-ylidene)propanedinitrile
Also Known As: 2-(1H-Benzo[d]imidazol-2(3H)-ylidene)malononitrile, 2-(1,3-dihydrobenzimidazol-2-ylidene)propanedinitrile, (benzimidazolidin-2-ylidene)malononitrile, J1.208.905H, [1H-Benzimidazole-2(3H)-ylidene]malononitrile
| Molecular Formula | C10H6N4 |
|---|---|
| Molecular Weight | 182.06 g/mol |
| LogP | 1.78276 |
| Topological Polar Surface Area | 71.64 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 0 |
| Exact Mass | 182.05925 |
| Heavy Atoms | 14 |
| Complexity | 444.57883 |
Chemical Identifiers
| CAS Number | 4933-40-8 |
|---|---|
| SMILES | C1=CC=C2C(=C1)NC(=C(C#N)C#N)N2 |
Product Overview
2-(1H-Benzo[d]imidazol-2(3H)-ylidene)malononitrile (CAS 4933-40-8), with molecular formula C10H6N4 and molecular weight 182.06 g/mol. IUPAC: 2-(1,3-dihydrobenzimidazol-2-ylidene)propanedinitrile.
Chemical Property Profile of 2-(1H-Benzo[d]imidazol-2(3H)-ylidene)malononitrile
Property Insights of 2-(1H-Benzo[d]imidazol-2(3H)-ylidene)malononitrile
The XLogP value of 1.78276 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(1H-Benzo[d]imidazol-2(3H)-ylidene)malononitrile. The TPSA of 71.64 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(1H-Benzo[d]imidazol-2(3H)-ylidene)malononitrile. Following Lipinski's Rule of Five, 2-(1H-Benzo[d]imidazol-2(3H)-ylidene)malononitrile 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-(1H-Benzo[d]imidazol-2(3H)-ylidene)malononitrile?
The CAS number of 2-(1H-Benzo[d]imidazol-2(3H)-ylidene)malononitrile is 4933-40-8.
What is the molecular formula of 2-(1H-Benzo[d]imidazol-2(3H)-ylidene)malononitrile?
The molecular formula of 2-(1H-Benzo[d]imidazol-2(3H)-ylidene)malononitrile is C10H6N4.
What is the molecular weight of 2-(1H-Benzo[d]imidazol-2(3H)-ylidene)malononitrile?
The molecular weight of 2-(1H-Benzo[d]imidazol-2(3H)-ylidene)malononitrile is 182.06 g/mol.
Where can I buy 2-(1H-Benzo[d]imidazol-2(3H)-ylidene)malononitrile?
You can request a quote for 2-(1H-Benzo[d]imidazol-2(3H)-ylidene)malononitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(1H-Benzo[d]imidazol-2(3H)-ylidene)malononitrile?
Yes, KEHONG BIO provides custom synthesis services for 2-(1H-Benzo[d]imidazol-2(3H)-ylidene)malononitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.