2-(benzenesulfonyl)-N-methoxy-2-nitroethanimine
TL;DR: 2-(benzenesulfonyl)-N-methoxy-2-nitroethanimine (CAS 338397-66-3) is a chemical compound with molecular formula C9H10N2O5S and molecular weight 258.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(benzenesulfonyl)-N-methoxy-2-nitroethanimine
Also Known As: 2-(benzenesulfonyl)-N-methoxy-2-nitroethanimine, 2-nitro-2-(phenylsulfonyl)acetaldehyde O-methyloxime, 2-Nitro-2-(phenylsulfonyl)acetaldehyde O-methyl oxime
| Molecular Formula | C9H10N2O5S |
|---|---|
| Molecular Weight | 258.03 g/mol |
| LogP | 0.6953 |
| Topological Polar Surface Area | 98.87 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 258.03104 |
| Heavy Atoms | 17 |
| Complexity | 511.44757 |
Chemical Identifiers
| CAS Number | 338397-66-3 |
|---|---|
| SMILES | CON=CC([N+](=O)[O-])S(=O)(=O)C1=CC=CC=C1 |
Product Overview
2-(benzenesulfonyl)-N-methoxy-2-nitroethanimine (CAS 338397-66-3), with molecular formula C9H10N2O5S and molecular weight 258.03 g/mol. IUPAC: 2-(benzenesulfonyl)-N-methoxy-2-nitroethanimine.
Chemical Property Profile of 2-(benzenesulfonyl)-N-methoxy-2-nitroethanimine
Property Insights of 2-(benzenesulfonyl)-N-methoxy-2-nitroethanimine
The XLogP value of 0.6953 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(benzenesulfonyl)-N-methoxy-2-nitroethanimine. The TPSA of 98.87 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(benzenesulfonyl)-N-methoxy-2-nitroethanimine. Following Lipinski's Rule of Five, 2-(benzenesulfonyl)-N-methoxy-2-nitroethanimine 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 2-(benzenesulfonyl)-N-methoxy-2-nitroethanimine?
The CAS number of 2-(benzenesulfonyl)-N-methoxy-2-nitroethanimine is 338397-66-3.
What is the molecular formula of 2-(benzenesulfonyl)-N-methoxy-2-nitroethanimine?
The molecular formula of 2-(benzenesulfonyl)-N-methoxy-2-nitroethanimine is C9H10N2O5S.
What is the molecular weight of 2-(benzenesulfonyl)-N-methoxy-2-nitroethanimine?
The molecular weight of 2-(benzenesulfonyl)-N-methoxy-2-nitroethanimine is 258.03 g/mol.
Where can I buy 2-(benzenesulfonyl)-N-methoxy-2-nitroethanimine?
You can request a quote for 2-(benzenesulfonyl)-N-methoxy-2-nitroethanimine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(benzenesulfonyl)-N-methoxy-2-nitroethanimine?
Yes, KEHONG BIO provides custom synthesis services for 2-(benzenesulfonyl)-N-methoxy-2-nitroethanimine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.