Acetic acid, cyano((3-nitrophenyl)hydrazono)-, pentyl ester
TL;DR: Acetic acid, cyano((3-nitrophenyl)hydrazono)-, pentyl ester (CAS 59062-23-6) is a chemical compound with molecular formula C14H16N4O4 and molecular weight 304.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
pentyl (2E)-2-cyano-2-[(3-nitrophenyl)hydrazinylidene]acetate
Also Known As: Cyanoglyoxylic acid pentyl ester 2-(m-nitrophenyl)hydrazone, ACETIC ACID, CYANO((3-NITROPHENYL)HYDRAZONO)-, PENTYL ESTER, Glyoxylic acid, cyano-, pentyl ester, 2-(m-nitrophenyl)hydrazone, RefChem:1075777
| Molecular Formula | C14H16N4O4 |
|---|---|
| Molecular Weight | 304.12 g/mol |
| LogP | 2.61968 |
| Topological Polar Surface Area | 117.62 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 8 |
| Exact Mass | 304.11716 |
| Heavy Atoms | 22 |
| Complexity | 607.1055 |
Chemical Identifiers
| CAS Number | 59062-23-6 |
|---|---|
| SMILES | CCCCCOC(=O)/C(=N/NC1=CC(=CC=C1)[N+](=O)[O-])/C#N |
Product Overview
Acetic acid, cyano((3-nitrophenyl)hydrazono)-, pentyl ester (CAS 59062-23-6), with molecular formula C14H16N4O4 and molecular weight 304.12 g/mol. IUPAC: pentyl (2E)-2-cyano-2-[(3-nitrophenyl)hydrazinylidene]acetate.
Chemical Property Profile of Acetic acid, cyano((3-nitrophenyl)hydrazono)-, pentyl ester
Property Insights of Acetic acid, cyano((3-nitrophenyl)hydrazono)-, pentyl ester
The XLogP value of 2.61968 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Acetic acid, cyano((3-nitrophenyl)hydrazono)-, pentyl ester. The TPSA of 117.62 Ų falls within the moderate polarity range, balancing permeability and solubility for Acetic acid, cyano((3-nitrophenyl)hydrazono)-, pentyl ester. Following Lipinski's Rule of Five, Acetic acid, cyano((3-nitrophenyl)hydrazono)-, pentyl ester has 1 hydrogen bond donor(s) and 7 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 Acetic acid, cyano((3-nitrophenyl)hydrazono)-, pentyl ester?
The CAS number of Acetic acid, cyano((3-nitrophenyl)hydrazono)-, pentyl ester is 59062-23-6.
What is the molecular formula of Acetic acid, cyano((3-nitrophenyl)hydrazono)-, pentyl ester?
The molecular formula of Acetic acid, cyano((3-nitrophenyl)hydrazono)-, pentyl ester is C14H16N4O4.
What is the molecular weight of Acetic acid, cyano((3-nitrophenyl)hydrazono)-, pentyl ester?
The molecular weight of Acetic acid, cyano((3-nitrophenyl)hydrazono)-, pentyl ester is 304.12 g/mol.
Where can I buy Acetic acid, cyano((3-nitrophenyl)hydrazono)-, pentyl ester?
You can request a quote for Acetic acid, cyano((3-nitrophenyl)hydrazono)-, pentyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Acetic acid, cyano((3-nitrophenyl)hydrazono)-, pentyl ester?
Yes, KEHONG BIO provides custom synthesis services for Acetic acid, cyano((3-nitrophenyl)hydrazono)-, pentyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.