Carbonyl cyanide-4-nitro-2-chlorophenylhydrazone
TL;DR: Carbonyl cyanide-4-nitro-2-chlorophenylhydrazone (CAS 3780-92-5) is a chemical compound with molecular formula C9H4ClN5O2 and molecular weight 249.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(2-chloro-4-nitrophenyl)hydrazinylidene]propanedinitrile
Also Known As: NCCCP, Carbonyl cyanide-4-nitro-2-chlorophenylhydrazone, 2-[(2-chloro-4-nitrophenyl)hydrazinylidene]propanedinitrile, ((2-Chloro-4-nitrophenyl)hydrazono)propanedinitrile, Mesoxalonitrile, (2-chloro-4-nitrophenyl)hydrazone
| Molecular Formula | C9H4ClN5O2 |
|---|---|
| Molecular Weight | 249.01 g/mol |
| LogP | 2.9 |
| Topological Polar Surface Area | 118.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 2 |
| Exact Mass | 249.00536 |
| Heavy Atoms | 17 |
| Complexity | 408.0 |
Chemical Identifiers
| CAS Number | 3780-92-5 |
|---|---|
| SMILES | C1=CC(=C(C=C1[N+](=O)[O-])Cl)NN=C(C#N)C#N |
| InChIKey | CADJTWAMRPGJBG-UHFFFAOYSA-N |
Product Overview
Carbonyl cyanide-4-nitro-2-chlorophenylhydrazone (CAS 3780-92-5), with molecular formula C9H4ClN5O2 and molecular weight 249.01 g/mol. IUPAC: 2-[(2-chloro-4-nitrophenyl)hydrazinylidene]propanedinitrile.
Chemical Property Profile of Carbonyl cyanide-4-nitro-2-chlorophenylhydrazone
Property Insights of Carbonyl cyanide-4-nitro-2-chlorophenylhydrazone
The XLogP value of 2.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Carbonyl cyanide-4-nitro-2-chlorophenylhydrazone. The TPSA of 118.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Carbonyl cyanide-4-nitro-2-chlorophenylhydrazone. Following Lipinski's Rule of Five, Carbonyl cyanide-4-nitro-2-chlorophenylhydrazone has 1 hydrogen bond donor(s) and 6 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 Carbonyl cyanide-4-nitro-2-chlorophenylhydrazone?
The CAS number of Carbonyl cyanide-4-nitro-2-chlorophenylhydrazone is 3780-92-5.
What is the molecular formula of Carbonyl cyanide-4-nitro-2-chlorophenylhydrazone?
The molecular formula of Carbonyl cyanide-4-nitro-2-chlorophenylhydrazone is C9H4ClN5O2.
What is the molecular weight of Carbonyl cyanide-4-nitro-2-chlorophenylhydrazone?
The molecular weight of Carbonyl cyanide-4-nitro-2-chlorophenylhydrazone is 249.01 g/mol.
Where can I buy Carbonyl cyanide-4-nitro-2-chlorophenylhydrazone?
You can request a quote for Carbonyl cyanide-4-nitro-2-chlorophenylhydrazone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Carbonyl cyanide-4-nitro-2-chlorophenylhydrazone?
Yes, KEHONG BIO provides custom synthesis services for Carbonyl cyanide-4-nitro-2-chlorophenylhydrazone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.