Diethyl 2-(2-(2-nitrophenyl)hydrazono)malonate
TL;DR: Diethyl 2-(2-(2-nitrophenyl)hydrazono)malonate (CAS 13631-92-0) is a chemical compound with molecular formula C13H15N3O6 and molecular weight 309.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
diethyl 2-[(2-nitrophenyl)hydrazinylidene]propanedioate
Also Known As: Diethyl 2-(2-(2-nitrophenyl)hydrazono)malonate, BAS 15345469, diethyl 2-[(2-nitrophenyl)hydrazinylidene]propanedioate, 1,3-DIETHYL 2-[2-(2-NITROPHENYL)HYDRAZIN-1-YLIDENE]PROPANEDIOATE, Diethyl2-(2-(2-nitrophenyl)hydrazono)malonate
| Molecular Formula | C13H15N3O6 |
|---|---|
| Molecular Weight | 309.10 g/mol |
| LogP | 1.4889 |
| Topological Polar Surface Area | 120.13 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 7 |
| Exact Mass | 309.0961 |
| Heavy Atoms | 22 |
| Complexity | 579.1932 |
Chemical Identifiers
| CAS Number | 13631-92-0 |
|---|---|
| SMILES | CCOC(=O)C(=NNC1=CC=CC=C1[N+](=O)[O-])C(=O)OCC |
Product Overview
Diethyl 2-(2-(2-nitrophenyl)hydrazono)malonate (CAS 13631-92-0), with molecular formula C13H15N3O6 and molecular weight 309.10 g/mol. IUPAC: diethyl 2-[(2-nitrophenyl)hydrazinylidene]propanedioate.
Chemical Property Profile of Diethyl 2-(2-(2-nitrophenyl)hydrazono)malonate
Property Insights of Diethyl 2-(2-(2-nitrophenyl)hydrazono)malonate
The XLogP value of 1.4889 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Diethyl 2-(2-(2-nitrophenyl)hydrazono)malonate. The TPSA of 120.13 Ų falls within the moderate polarity range, balancing permeability and solubility for Diethyl 2-(2-(2-nitrophenyl)hydrazono)malonate. Following Lipinski's Rule of Five, Diethyl 2-(2-(2-nitrophenyl)hydrazono)malonate has 1 hydrogen bond donor(s) and 8 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 Diethyl 2-(2-(2-nitrophenyl)hydrazono)malonate?
The CAS number of Diethyl 2-(2-(2-nitrophenyl)hydrazono)malonate is 13631-92-0.
What is the molecular formula of Diethyl 2-(2-(2-nitrophenyl)hydrazono)malonate?
The molecular formula of Diethyl 2-(2-(2-nitrophenyl)hydrazono)malonate is C13H15N3O6.
What is the molecular weight of Diethyl 2-(2-(2-nitrophenyl)hydrazono)malonate?
The molecular weight of Diethyl 2-(2-(2-nitrophenyl)hydrazono)malonate is 309.10 g/mol.
Where can I buy Diethyl 2-(2-(2-nitrophenyl)hydrazono)malonate?
You can request a quote for Diethyl 2-(2-(2-nitrophenyl)hydrazono)malonate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Diethyl 2-(2-(2-nitrophenyl)hydrazono)malonate?
Yes, KEHONG BIO provides custom synthesis services for Diethyl 2-(2-(2-nitrophenyl)hydrazono)malonate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.