[3-Acetyloxy-2-(acetyloxymethyl)-2-nitropropyl] acetate
TL;DR: [3-Acetyloxy-2-(acetyloxymethyl)-2-nitropropyl] acetate (CAS 7344-23-2) is a chemical compound with molecular formula C10H15NO8 and molecular weight 277.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[3-acetyloxy-2-(acetyloxymethyl)-2-nitropropyl] acetate
Also Known As: [3-acetyloxy-2-(acetyloxymethyl)-2-nitropropyl] acetate|Propane, 1,3-diacetoxy-2-acetoxymethyl-2-nitro-|1,3-Propanediol, 2-hydroxymethyl-2-nitro-, triacetate|2-[(Acetyloxy)methyl]-2-nitropropane-1,3-diyl diacetate|3-(Acetyloxy)-2-[(acetyloxy)methyl]-2-nitropropyl acetate #|MESPONKCPLGERO-UHFFFAOYSA-N
| Molecular Formula | C10H15NO8 |
|---|---|
| Molecular Weight | 277.08 g/mol |
| LogP | -0.4 |
| Topological Polar Surface Area | 125.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 9 |
| Exact Mass | 277.07977 |
| Heavy Atoms | 19 |
| Complexity | 327.0 |
Chemical Identifiers
| CAS Number | 7344-23-2 |
|---|---|
| SMILES | CC(=O)OCC(COC(=O)C)(COC(=O)C)[N+](=O)[O-] |
| InChIKey | MESPONKCPLGERO-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
[3-Acetyloxy-2-(acetyloxymethyl)-2-nitropropyl] acetate (CAS 7344-23-2), with molecular formula C10H15NO8 and molecular weight 277.08 g/mol. IUPAC: [3-acetyloxy-2-(acetyloxymethyl)-2-nitropropyl] acetate.
Chemical Property Profile of [3-Acetyloxy-2-(acetyloxymethyl)-2-nitropropyl] acetate
Property Insights of [3-Acetyloxy-2-(acetyloxymethyl)-2-nitropropyl] acetate
The XLogP value of -0.4 indicates that [3-Acetyloxy-2-(acetyloxymethyl)-2-nitropropyl] acetate is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 125.0 Ų falls within the moderate polarity range, balancing permeability and solubility for [3-Acetyloxy-2-(acetyloxymethyl)-2-nitropropyl] acetate. Following Lipinski's Rule of Five, [3-Acetyloxy-2-(acetyloxymethyl)-2-nitropropyl] acetate has 0 hydrogen bond donor(s) and 8 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 [3-Acetyloxy-2-(acetyloxymethyl)-2-nitropropyl] acetate?
The CAS number of [3-Acetyloxy-2-(acetyloxymethyl)-2-nitropropyl] acetate is 7344-23-2.
What is the molecular formula of [3-Acetyloxy-2-(acetyloxymethyl)-2-nitropropyl] acetate?
The molecular formula of [3-Acetyloxy-2-(acetyloxymethyl)-2-nitropropyl] acetate is C10H15NO8.
What is the molecular weight of [3-Acetyloxy-2-(acetyloxymethyl)-2-nitropropyl] acetate?
The molecular weight of [3-Acetyloxy-2-(acetyloxymethyl)-2-nitropropyl] acetate is 277.08 g/mol.
Where can I buy [3-Acetyloxy-2-(acetyloxymethyl)-2-nitropropyl] acetate?
You can request a quote for [3-Acetyloxy-2-(acetyloxymethyl)-2-nitropropyl] acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for [3-Acetyloxy-2-(acetyloxymethyl)-2-nitropropyl] acetate?
Yes, KEHONG BIO provides custom synthesis services for [3-Acetyloxy-2-(acetyloxymethyl)-2-nitropropyl] acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.