Sydnone imine, 3-ethyl-, monohydrochloride
TL;DR: Sydnone imine, 3-ethyl-, monohydrochloride (CAS 5596-04-3) is a chemical compound with molecular formula C4H8ClN3O and molecular weight 149.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-ethyloxadiazol-3-ium-5-amine chloride
Also Known As: 3-Ethylsydnonimine hydrochloride, 3-Ethylsydnone imine hydrochloride, 3-Ethyl-sydnone imine hydrochloride, Sydnone imine, 3-ethyl-, monohydrochloride, 3-ethyloxadiazol-3-ium-5-amine chloride
| Molecular Formula | C4H8ClN3O |
|---|---|
| Molecular Weight | 149.04 g/mol |
| LogP | -3.4318 |
| Topological Polar Surface Area | 55.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 149.03558 |
| Heavy Atoms | 9 |
| Complexity | 77.0 |
Chemical Identifiers
| CAS Number | 5596-04-3 |
|---|---|
| SMILES | CC[N+]1=NOC(=C1)N.[Cl-] |
| InChIKey | GSOHYOBUFVCQDP-UHFFFAOYSA-M |
Product Overview
Sydnone imine, 3-ethyl-, monohydrochloride (CAS 5596-04-3), with molecular formula C4H8ClN3O and molecular weight 149.04 g/mol. IUPAC: 3-ethyloxadiazol-3-ium-5-amine chloride.
Chemical Property Profile of Sydnone imine, 3-ethyl-, monohydrochloride
Property Insights of Sydnone imine, 3-ethyl-, monohydrochloride
The XLogP value of -3.4318 indicates that Sydnone imine, 3-ethyl-, monohydrochloride is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 55.9 Ų, Sydnone imine, 3-ethyl-, monohydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Sydnone imine, 3-ethyl-, monohydrochloride has 1 hydrogen bond donor(s) and 4 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 Sydnone imine, 3-ethyl-, monohydrochloride?
The CAS number of Sydnone imine, 3-ethyl-, monohydrochloride is 5596-04-3.
What is the molecular formula of Sydnone imine, 3-ethyl-, monohydrochloride?
The molecular formula of Sydnone imine, 3-ethyl-, monohydrochloride is C4H8ClN3O.
What is the molecular weight of Sydnone imine, 3-ethyl-, monohydrochloride?
The molecular weight of Sydnone imine, 3-ethyl-, monohydrochloride is 149.04 g/mol.
Where can I buy Sydnone imine, 3-ethyl-, monohydrochloride?
You can request a quote for Sydnone imine, 3-ethyl-, monohydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Sydnone imine, 3-ethyl-, monohydrochloride?
Yes, KEHONG BIO provides custom synthesis services for Sydnone imine, 3-ethyl-, monohydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.