2-[(4-Chloro-3-nitrophenyl)hydrazinylidene]propanedinitrile
TL;DR: 2-[(4-Chloro-3-nitrophenyl)hydrazinylidene]propanedinitrile (CAS 328027-16-3) 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-[(4-chloro-3-nitrophenyl)hydrazinylidene]propanedinitrile
Also Known As: 2-({4-Chloro-3-nitrophenyl}, [(4-chloro-3-nitrophenyl)hydrazono]malononitrile, 2-({4-chloro-3-nitrophenyl}hydrazono)malononitrile, 2-[(4-chloro-3-nitrophenyl)hydrazinylidene]propanedinitrile, AN-329/40487164
| Molecular Formula | C9H4ClN5O2 |
|---|---|
| Molecular Weight | 249.01 g/mol |
| LogP | 3.1 |
| 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 | 328027-16-3 |
|---|---|
| SMILES | C1=CC(=C(C=C1NN=C(C#N)C#N)[N+](=O)[O-])Cl |
| InChIKey | IUPSBCHTLCOSAJ-UHFFFAOYSA-N |
Product Overview
2-[(4-Chloro-3-nitrophenyl)hydrazinylidene]propanedinitrile (CAS 328027-16-3), with molecular formula C9H4ClN5O2 and molecular weight 249.01 g/mol. IUPAC: 2-[(4-chloro-3-nitrophenyl)hydrazinylidene]propanedinitrile.
Chemical Property Profile of 2-[(4-Chloro-3-nitrophenyl)hydrazinylidene]propanedinitrile
Property Insights of 2-[(4-Chloro-3-nitrophenyl)hydrazinylidene]propanedinitrile
The XLogP value of 3.1 indicates that 2-[(4-Chloro-3-nitrophenyl)hydrazinylidene]propanedinitrile is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 118.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-[(4-Chloro-3-nitrophenyl)hydrazinylidene]propanedinitrile. Following Lipinski's Rule of Five, 2-[(4-Chloro-3-nitrophenyl)hydrazinylidene]propanedinitrile 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 2-[(4-Chloro-3-nitrophenyl)hydrazinylidene]propanedinitrile?
The CAS number of 2-[(4-Chloro-3-nitrophenyl)hydrazinylidene]propanedinitrile is 328027-16-3.
What is the molecular formula of 2-[(4-Chloro-3-nitrophenyl)hydrazinylidene]propanedinitrile?
The molecular formula of 2-[(4-Chloro-3-nitrophenyl)hydrazinylidene]propanedinitrile is C9H4ClN5O2.
What is the molecular weight of 2-[(4-Chloro-3-nitrophenyl)hydrazinylidene]propanedinitrile?
The molecular weight of 2-[(4-Chloro-3-nitrophenyl)hydrazinylidene]propanedinitrile is 249.01 g/mol.
Where can I buy 2-[(4-Chloro-3-nitrophenyl)hydrazinylidene]propanedinitrile?
You can request a quote for 2-[(4-Chloro-3-nitrophenyl)hydrazinylidene]propanedinitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-[(4-Chloro-3-nitrophenyl)hydrazinylidene]propanedinitrile?
Yes, KEHONG BIO provides custom synthesis services for 2-[(4-Chloro-3-nitrophenyl)hydrazinylidene]propanedinitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.