Oxiran-2-ylmethyl 4-nitrobenzenesulfonate
TL;DR: Oxiran-2-ylmethyl 4-nitrobenzenesulfonate (CAS 56100-19-7) is a chemical compound with molecular formula C9H9NO6S and molecular weight 259.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
oxiran-2-ylmethyl 4-nitrobenzenesulfonate
Also Known As: glycidyl nosylate, oxiran-2-ylmethyl 4-nitrobenzenesulfonate, S-Glycidyl nosylate, 2-Chloromethyl-pyrazine, (S)-Glycidyl-4-nosylate
| Molecular Formula | C9H9NO6S |
|---|---|
| Molecular Weight | 259.02 g/mol |
| LogP | 0.7 |
| Topological Polar Surface Area | 110.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 259.01505 |
| Heavy Atoms | 17 |
| Complexity | 375.0 |
Chemical Identifiers
| CAS Number | 56100-19-7 |
|---|---|
| SMILES | C1C(O1)COS(=O)(=O)C2=CC=C(C=C2)[N+](=O)[O-] |
| InChIKey | CXYDYDCHYJXOEY-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 6 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Oxiran-2-ylmethyl 4-nitrobenzenesulfonate (CAS 56100-19-7), with molecular formula C9H9NO6S and molecular weight 259.02 g/mol. IUPAC: oxiran-2-ylmethyl 4-nitrobenzenesulfonate.
Chemical Property Profile of Oxiran-2-ylmethyl 4-nitrobenzenesulfonate
Property Insights of Oxiran-2-ylmethyl 4-nitrobenzenesulfonate
The XLogP value of 0.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Oxiran-2-ylmethyl 4-nitrobenzenesulfonate. The TPSA of 110.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Oxiran-2-ylmethyl 4-nitrobenzenesulfonate. Following Lipinski's Rule of Five, Oxiran-2-ylmethyl 4-nitrobenzenesulfonate 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 Oxiran-2-ylmethyl 4-nitrobenzenesulfonate?
The CAS number of Oxiran-2-ylmethyl 4-nitrobenzenesulfonate is 56100-19-7.
What is the molecular formula of Oxiran-2-ylmethyl 4-nitrobenzenesulfonate?
The molecular formula of Oxiran-2-ylmethyl 4-nitrobenzenesulfonate is C9H9NO6S.
What is the molecular weight of Oxiran-2-ylmethyl 4-nitrobenzenesulfonate?
The molecular weight of Oxiran-2-ylmethyl 4-nitrobenzenesulfonate is 259.02 g/mol.
Where can I buy Oxiran-2-ylmethyl 4-nitrobenzenesulfonate?
You can request a quote for Oxiran-2-ylmethyl 4-nitrobenzenesulfonate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Oxiran-2-ylmethyl 4-nitrobenzenesulfonate?
Yes, KEHONG BIO provides custom synthesis services for Oxiran-2-ylmethyl 4-nitrobenzenesulfonate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.