(3-Acetyloxy-2-bromo-2-nitropropyl) acetate
TL;DR: (3-Acetyloxy-2-bromo-2-nitropropyl) acetate (CAS 34564-38-0) is a chemical compound with molecular formula C7H10BrNO6 and molecular weight 282.97 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(3-acetyloxy-2-bromo-2-nitropropyl) acetate
Also Known As: (3-acetyloxy-2-bromo-2-nitropropyl) acetate, 1,3-DIACETOXY-2-BROMO-2-NITROPROPANE, 2-bromo-2-nitro-1,3-diacetyloxypropane, 2-bromo-2-nitro-1,3-diacetoxypropane, 2-bromo-2-nitropropane-1,3-diyl diacetate
| Molecular Formula | C7H10BrNO6 |
|---|---|
| Molecular Weight | 282.97 g/mol |
| LogP | 0.4805 |
| Topological Polar Surface Area | 95.74 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 282.96915 |
| Heavy Atoms | 15 |
| Complexity | 260.65396 |
Chemical Identifiers
| CAS Number | 34564-38-0 |
|---|---|
| SMILES | CC(=O)OCC(COC(=O)C)([N+](=O)[O-])Br |
Product Overview
(3-Acetyloxy-2-bromo-2-nitropropyl) acetate (CAS 34564-38-0), with molecular formula C7H10BrNO6 and molecular weight 282.97 g/mol. IUPAC: (3-acetyloxy-2-bromo-2-nitropropyl) acetate.
Chemical Property Profile of (3-Acetyloxy-2-bromo-2-nitropropyl) acetate
Property Insights of (3-Acetyloxy-2-bromo-2-nitropropyl) acetate
The XLogP value of 0.4805 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (3-Acetyloxy-2-bromo-2-nitropropyl) acetate. The TPSA of 95.74 Ų falls within the moderate polarity range, balancing permeability and solubility for (3-Acetyloxy-2-bromo-2-nitropropyl) acetate. Following Lipinski's Rule of Five, (3-Acetyloxy-2-bromo-2-nitropropyl) acetate 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 (3-Acetyloxy-2-bromo-2-nitropropyl) acetate?
The CAS number of (3-Acetyloxy-2-bromo-2-nitropropyl) acetate is 34564-38-0.
What is the molecular formula of (3-Acetyloxy-2-bromo-2-nitropropyl) acetate?
The molecular formula of (3-Acetyloxy-2-bromo-2-nitropropyl) acetate is C7H10BrNO6.
What is the molecular weight of (3-Acetyloxy-2-bromo-2-nitropropyl) acetate?
The molecular weight of (3-Acetyloxy-2-bromo-2-nitropropyl) acetate is 282.97 g/mol.
Where can I buy (3-Acetyloxy-2-bromo-2-nitropropyl) acetate?
You can request a quote for (3-Acetyloxy-2-bromo-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-bromo-2-nitropropyl) acetate?
Yes, KEHONG BIO provides custom synthesis services for (3-Acetyloxy-2-bromo-2-nitropropyl) acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.