4-(2-Nitrobutyl)morpholine
TL;DR: 4-(2-Nitrobutyl)morpholine (CAS 2224-44-4) is a chemical compound with molecular formula C8H16N2O3 and molecular weight 188.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(2-nitrobutyl)morpholine
Also Known As: 4-(2-Nitrobutyl)morpholine, Vancide 40, Vancide F 5386, N-(2-Nitrobutyl)morpholine, Caswell No. 601A
| Molecular Formula | C8H16N2O3 |
|---|---|
| Molecular Weight | 188.12 g/mol |
| LogP | 0.6 |
| Topological Polar Surface Area | 58.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 188.11609 |
| Heavy Atoms | 13 |
| Complexity | 163.0 |
Chemical Identifiers
| CAS Number | 2224-44-4 |
|---|---|
| SMILES | CCC(CN1CCOCC1)[N+](=O)[O-] |
| InChIKey | GQHVWDKJTDUZRP-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 15 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4-(2-Nitrobutyl)morpholine (CAS 2224-44-4), with molecular formula C8H16N2O3 and molecular weight 188.12 g/mol. IUPAC: 4-(2-nitrobutyl)morpholine.
Chemical Property Profile of 4-(2-Nitrobutyl)morpholine
Property Insights of 4-(2-Nitrobutyl)morpholine
The XLogP value of 0.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-(2-Nitrobutyl)morpholine. With a topological polar surface area (TPSA) of 58.3 Ų, 4-(2-Nitrobutyl)morpholine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-(2-Nitrobutyl)morpholine has 0 hydrogen bond donor(s) and 4 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 4-(2-Nitrobutyl)morpholine?
The CAS number of 4-(2-Nitrobutyl)morpholine is 2224-44-4.
What is the molecular formula of 4-(2-Nitrobutyl)morpholine?
The molecular formula of 4-(2-Nitrobutyl)morpholine is C8H16N2O3.
What is the molecular weight of 4-(2-Nitrobutyl)morpholine?
The molecular weight of 4-(2-Nitrobutyl)morpholine is 188.12 g/mol.
Where can I buy 4-(2-Nitrobutyl)morpholine?
You can request a quote for 4-(2-Nitrobutyl)morpholine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-(2-Nitrobutyl)morpholine?
Yes, KEHONG BIO provides custom synthesis services for 4-(2-Nitrobutyl)morpholine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.