S-(2,4-dinitrophenyl)-N-(propan-2-ylidene)thiohydroxylamine
TL;DR: S-(2,4-dinitrophenyl)-N-(propan-2-ylidene)thiohydroxylamine (CAS 67157-17-9) is a chemical compound with molecular formula C9H9N3O4S and molecular weight 255.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(2,4-dinitrophenyl)sulfanylpropan-2-imine
Also Known As: N-(2,4-dinitrophenyl)sulfanylpropan-2-imine, S-(2,4-dinitrophenyl)-N-(propan-2-ylidene)thiohydroxylamine
| Molecular Formula | C9H9N3O4S |
|---|---|
| Molecular Weight | 255.03 g/mol |
| LogP | 2.9909 |
| Topological Polar Surface Area | 98.64 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 255.03137 |
| Heavy Atoms | 17 |
| Complexity | 497.01437 |
Chemical Identifiers
| CAS Number | 67157-17-9 |
|---|---|
| SMILES | CC(=NSC1=C(C=C(C=C1)[N+](=O)[O-])[N+](=O)[O-])C |
Product Overview
S-(2,4-dinitrophenyl)-N-(propan-2-ylidene)thiohydroxylamine (CAS 67157-17-9), with molecular formula C9H9N3O4S and molecular weight 255.03 g/mol. IUPAC: N-(2,4-dinitrophenyl)sulfanylpropan-2-imine.
Chemical Property Profile of S-(2,4-dinitrophenyl)-N-(propan-2-ylidene)thiohydroxylamine
Property Insights of S-(2,4-dinitrophenyl)-N-(propan-2-ylidene)thiohydroxylamine
The XLogP value of 2.9909 suggests moderate lipophilicity, balancing water solubility and membrane permeability for S-(2,4-dinitrophenyl)-N-(propan-2-ylidene)thiohydroxylamine. The TPSA of 98.64 Ų falls within the moderate polarity range, balancing permeability and solubility for S-(2,4-dinitrophenyl)-N-(propan-2-ylidene)thiohydroxylamine. Following Lipinski's Rule of Five, S-(2,4-dinitrophenyl)-N-(propan-2-ylidene)thiohydroxylamine has 0 hydrogen bond donor(s) and 6 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 S-(2,4-dinitrophenyl)-N-(propan-2-ylidene)thiohydroxylamine?
The CAS number of S-(2,4-dinitrophenyl)-N-(propan-2-ylidene)thiohydroxylamine is 67157-17-9.
What is the molecular formula of S-(2,4-dinitrophenyl)-N-(propan-2-ylidene)thiohydroxylamine?
The molecular formula of S-(2,4-dinitrophenyl)-N-(propan-2-ylidene)thiohydroxylamine is C9H9N3O4S.
What is the molecular weight of S-(2,4-dinitrophenyl)-N-(propan-2-ylidene)thiohydroxylamine?
The molecular weight of S-(2,4-dinitrophenyl)-N-(propan-2-ylidene)thiohydroxylamine is 255.03 g/mol.
Where can I buy S-(2,4-dinitrophenyl)-N-(propan-2-ylidene)thiohydroxylamine?
You can request a quote for S-(2,4-dinitrophenyl)-N-(propan-2-ylidene)thiohydroxylamine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for S-(2,4-dinitrophenyl)-N-(propan-2-ylidene)thiohydroxylamine?
Yes, KEHONG BIO provides custom synthesis services for S-(2,4-dinitrophenyl)-N-(propan-2-ylidene)thiohydroxylamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.