(Z)-(3-chlorophenyl)-ethoxycarbonylimino-oxidoazanium
TL;DR: (Z)-(3-chlorophenyl)-ethoxycarbonylimino-oxidoazanium (CAS 76869-80-2) is a chemical compound with molecular formula C9H9ClN2O3 and molecular weight 228.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(Z)-(3-chlorophenyl)-ethoxycarbonylimino-oxidoazanium
Also Known As: 1-Chloro-3-[(Z)-(ethoxycarbonyl)-NNO-azoxy]benzene
| Molecular Formula | C9H9ClN2O3 |
|---|---|
| Molecular Weight | 228.03 g/mol |
| LogP | 3.0905 |
| Topological Polar Surface Area | 64.73 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 228.03017 |
| Heavy Atoms | 15 |
| Complexity | 392.69876 |
Chemical Identifiers
| CAS Number | 76869-80-2 |
|---|---|
| SMILES | CCOC(=O)/N=[N+](/C1=CC(=CC=C1)Cl)\[O-] |
Product Overview
(Z)-(3-chlorophenyl)-ethoxycarbonylimino-oxidoazanium (CAS 76869-80-2), with molecular formula C9H9ClN2O3 and molecular weight 228.03 g/mol. IUPAC: (Z)-(3-chlorophenyl)-ethoxycarbonylimino-oxidoazanium.
Chemical Property Profile of (Z)-(3-chlorophenyl)-ethoxycarbonylimino-oxidoazanium
Property Insights of (Z)-(3-chlorophenyl)-ethoxycarbonylimino-oxidoazanium
The XLogP value of 3.0905 indicates that (Z)-(3-chlorophenyl)-ethoxycarbonylimino-oxidoazanium is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 64.73 Ų falls within the moderate polarity range, balancing permeability and solubility for (Z)-(3-chlorophenyl)-ethoxycarbonylimino-oxidoazanium. Following Lipinski's Rule of Five, (Z)-(3-chlorophenyl)-ethoxycarbonylimino-oxidoazanium has 0 hydrogen bond donor(s) and 3 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 (Z)-(3-chlorophenyl)-ethoxycarbonylimino-oxidoazanium?
The CAS number of (Z)-(3-chlorophenyl)-ethoxycarbonylimino-oxidoazanium is 76869-80-2.
What is the molecular formula of (Z)-(3-chlorophenyl)-ethoxycarbonylimino-oxidoazanium?
The molecular formula of (Z)-(3-chlorophenyl)-ethoxycarbonylimino-oxidoazanium is C9H9ClN2O3.
What is the molecular weight of (Z)-(3-chlorophenyl)-ethoxycarbonylimino-oxidoazanium?
The molecular weight of (Z)-(3-chlorophenyl)-ethoxycarbonylimino-oxidoazanium is 228.03 g/mol.
Where can I buy (Z)-(3-chlorophenyl)-ethoxycarbonylimino-oxidoazanium?
You can request a quote for (Z)-(3-chlorophenyl)-ethoxycarbonylimino-oxidoazanium directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (Z)-(3-chlorophenyl)-ethoxycarbonylimino-oxidoazanium?
Yes, KEHONG BIO provides custom synthesis services for (Z)-(3-chlorophenyl)-ethoxycarbonylimino-oxidoazanium and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.