硝基-1-氧代丁基过氧化物
TL;DR: 硝基-1-氧代丁基过氧化物 (CAS 27746-48-1) is a chemical compound with molecular formula C4H7NO5 and molecular weight 149.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
硝基-1-氧代丁基过氧化物
nitro butaneperoxoate
Also Known As: nitro butaneperoxoate, Butyryloxynitrate, peroxybutyryl nitrate, Butyrylnitro peroxide, Peroxide, nitro 1-oxobutyl
| Molecular Formula | C4H7NO5 |
|---|---|
| Molecular Weight | 149.03 g/mol |
| LogP | 1.4 |
| Topological Polar Surface Area | 81.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 149.03242 |
| Heavy Atoms | 10 |
| Complexity | 128.0 |
Chemical Identifiers
| CAS Number | 27746-48-1 |
|---|---|
| SMILES | CCCC(=O)OO[N+](=O)[O-] |
| InChIKey | HZUMMZVMNQSPFF-UHFFFAOYSA-N |
Product Overview
硝基-1-氧代丁基过氧化物 (CAS 27746-48-1), with molecular formula C4H7NO5 and molecular weight 149.03 g/mol. IUPAC: nitro butaneperoxoate.
Chemical Property Profile of 硝基-1-氧代丁基过氧化物
Property Insights of 硝基-1-氧代丁基过氧化物
The XLogP value of 1.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 硝基-1-氧代丁基过氧化物. The TPSA of 81.4 Ų falls within the moderate polarity range, balancing permeability and solubility for 硝基-1-氧代丁基过氧化物. Following Lipinski's Rule of Five, 硝基-1-氧代丁基过氧化物 has 0 hydrogen bond donor(s) and 5 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 硝基-1-氧代丁基过氧化物?
The CAS number of 硝基-1-氧代丁基过氧化物 is 27746-48-1.
What is the molecular formula of 硝基-1-氧代丁基过氧化物?
The molecular formula of 硝基-1-氧代丁基过氧化物 is C4H7NO5.
What is the molecular weight of 硝基-1-氧代丁基过氧化物?
The molecular weight of 硝基-1-氧代丁基过氧化物 is 149.03 g/mol.
Where can I buy 硝基-1-氧代丁基过氧化物?
You can request a quote for 硝基-1-氧代丁基过氧化物 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 硝基-1-氧代丁基过氧化物?
Yes, KEHONG BIO provides custom synthesis services for 硝基-1-氧代丁基过氧化物 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.