(4-Bromophenyl)-ethoxycarbonylimino-oxidoazanium
TL;DR: (4-Bromophenyl)-ethoxycarbonylimino-oxidoazanium (CAS 76869-82-4) is a chemical compound with molecular formula C9H9BrN2O3 and molecular weight 271.98 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4-bromophenyl)-ethoxycarbonylimino-oxidoazanium
Also Known As: (4-bromophenyl)-ethoxycarbonylimino-oxidoazanium, (Z)-(4-bromophenyl)-ethoxycarbonylimino-oxidoazanium
| Molecular Formula | C9H9BrN2O3 |
|---|---|
| Molecular Weight | 271.98 g/mol |
| LogP | 3.2 |
| Topological Polar Surface Area | 67.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 271.97964 |
| Heavy Atoms | 15 |
| Complexity | 250.0 |
Chemical Identifiers
| CAS Number | 76869-82-4 |
|---|---|
| SMILES | CCOC(=O)N=[N+](C1=CC=C(C=C1)Br)[O-] |
| InChIKey | AIPQRJCXLLUIGB-UHFFFAOYSA-N |
Product Overview
(4-Bromophenyl)-ethoxycarbonylimino-oxidoazanium (CAS 76869-82-4), with molecular formula C9H9BrN2O3 and molecular weight 271.98 g/mol. IUPAC: (4-bromophenyl)-ethoxycarbonylimino-oxidoazanium.
Chemical Property Profile of (4-Bromophenyl)-ethoxycarbonylimino-oxidoazanium
Property Insights of (4-Bromophenyl)-ethoxycarbonylimino-oxidoazanium
The XLogP value of 3.2 indicates that (4-Bromophenyl)-ethoxycarbonylimino-oxidoazanium is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 67.4 Ų falls within the moderate polarity range, balancing permeability and solubility for (4-Bromophenyl)-ethoxycarbonylimino-oxidoazanium. Following Lipinski's Rule of Five, (4-Bromophenyl)-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 (4-Bromophenyl)-ethoxycarbonylimino-oxidoazanium?
The CAS number of (4-Bromophenyl)-ethoxycarbonylimino-oxidoazanium is 76869-82-4.
What is the molecular formula of (4-Bromophenyl)-ethoxycarbonylimino-oxidoazanium?
The molecular formula of (4-Bromophenyl)-ethoxycarbonylimino-oxidoazanium is C9H9BrN2O3.
What is the molecular weight of (4-Bromophenyl)-ethoxycarbonylimino-oxidoazanium?
The molecular weight of (4-Bromophenyl)-ethoxycarbonylimino-oxidoazanium is 271.98 g/mol.
Where can I buy (4-Bromophenyl)-ethoxycarbonylimino-oxidoazanium?
You can request a quote for (4-Bromophenyl)-ethoxycarbonylimino-oxidoazanium directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (4-Bromophenyl)-ethoxycarbonylimino-oxidoazanium?
Yes, KEHONG BIO provides custom synthesis services for (4-Bromophenyl)-ethoxycarbonylimino-oxidoazanium and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.