硝酸2-硝基乙酯
TL;DR: 硝酸2-硝基乙酯 (CAS 4528-34-1) is a chemical compound with molecular formula C2H4N2O5 and molecular weight 136.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
硝酸2-硝基乙酯
2-nitroethyl nitrate
Also Known As: 2-Nitroethyl nitrate, Nitroethyl nitrate, 2-Nitroethanol nitrate, 1-Nitro-2-nitryloxy-aethan, Ethanol, 2-nitro-, nitrate
| Molecular Formula | C2H4N2O5 |
|---|---|
| Molecular Weight | 136.01 g/mol |
| LogP | 0.3 |
| Topological Polar Surface Area | 101.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 136.01202 |
| Heavy Atoms | 9 |
| Complexity | 111.0 |
Chemical Identifiers
| CAS Number | 4528-34-1 |
|---|---|
| SMILES | C(CO[N+](=O)[O-])[N+](=O)[O-] |
| InChIKey | FRXFYZJACNONHT-UHFFFAOYSA-N |
Product Overview
硝酸2-硝基乙酯 (CAS 4528-34-1), with molecular formula C2H4N2O5 and molecular weight 136.01 g/mol. IUPAC: 2-nitroethyl nitrate.
Chemical Property Profile of 硝酸2-硝基乙酯
Property Insights of 硝酸2-硝基乙酯
The XLogP value of 0.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 硝酸2-硝基乙酯. The TPSA of 101.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 硝酸2-硝基乙酯. Following Lipinski's Rule of Five, 硝酸2-硝基乙酯 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 硝酸2-硝基乙酯?
The CAS number of 硝酸2-硝基乙酯 is 4528-34-1.
What is the molecular formula of 硝酸2-硝基乙酯?
The molecular formula of 硝酸2-硝基乙酯 is C2H4N2O5.
What is the molecular weight of 硝酸2-硝基乙酯?
The molecular weight of 硝酸2-硝基乙酯 is 136.01 g/mol.
Where can I buy 硝酸2-硝基乙酯?
You can request a quote for 硝酸2-硝基乙酯 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 硝酸2-硝基乙酯?
Yes, KEHONG BIO provides custom synthesis services for 硝酸2-硝基乙酯 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.