2-Acetoxyethyl p-nitrophenyl sulfone
TL;DR: 2-Acetoxyethyl p-nitrophenyl sulfone (CAS 38476-91-4) is a chemical compound with molecular formula C10H11NO6S and molecular weight 273.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(4-nitrophenyl)sulfonylethyl acetate
Also Known As: 2-Acetoxyethyl p-nitrophenyl sulfone, 2-Acetoxyethylp-nitrophenylsulfone, 2-(4-nitrophenyl)sulfonylethyl acetate, 2-(4-nitrobenzenesulfonyl)ethyl acetate, 2-[(4-Nitrophenyl)sulfonyl]ethyl acetate #
| Molecular Formula | C10H11NO6S |
|---|---|
| Molecular Weight | 273.03 g/mol |
| LogP | 0.9 |
| Topological Polar Surface Area | 115.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 273.0307 |
| Heavy Atoms | 18 |
| Complexity | 399.0 |
Chemical Identifiers
| CAS Number | 38476-91-4 |
|---|---|
| SMILES | CC(=O)OCCS(=O)(=O)C1=CC=C(C=C1)[N+](=O)[O-] |
| InChIKey | NDJZFIATIGTVMB-UHFFFAOYSA-N |
Product Overview
2-Acetoxyethyl p-nitrophenyl sulfone (CAS 38476-91-4), with molecular formula C10H11NO6S and molecular weight 273.03 g/mol. IUPAC: 2-(4-nitrophenyl)sulfonylethyl acetate.
Chemical Property Profile of 2-Acetoxyethyl p-nitrophenyl sulfone
Property Insights of 2-Acetoxyethyl p-nitrophenyl sulfone
The XLogP value of 0.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Acetoxyethyl p-nitrophenyl sulfone. The TPSA of 115.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Acetoxyethyl p-nitrophenyl sulfone. Following Lipinski's Rule of Five, 2-Acetoxyethyl p-nitrophenyl sulfone 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-Acetoxyethyl p-nitrophenyl sulfone?
The CAS number of 2-Acetoxyethyl p-nitrophenyl sulfone is 38476-91-4.
What is the molecular formula of 2-Acetoxyethyl p-nitrophenyl sulfone?
The molecular formula of 2-Acetoxyethyl p-nitrophenyl sulfone is C10H11NO6S.
What is the molecular weight of 2-Acetoxyethyl p-nitrophenyl sulfone?
The molecular weight of 2-Acetoxyethyl p-nitrophenyl sulfone is 273.03 g/mol.
Where can I buy 2-Acetoxyethyl p-nitrophenyl sulfone?
You can request a quote for 2-Acetoxyethyl p-nitrophenyl sulfone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Acetoxyethyl p-nitrophenyl sulfone?
Yes, KEHONG BIO provides custom synthesis services for 2-Acetoxyethyl p-nitrophenyl sulfone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.