(1-Tert-butyl-3-nitroazetidin-3-yl)methanol
TL;DR: (1-Tert-butyl-3-nitroazetidin-3-yl)methanol (CAS 158669-96-6) 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.
(1-tert-butyl-3-nitroazetidin-3-yl)methanol
Also Known As: (1-tert-butyl-3-nitroazetidin-3-yl)methanol, 1-t-butyl-3-hydroxymethyl-3-nitroazetidine, (1-(tert-butyl)-3-nitroazetidin-3-yl)methanol, [1-(tert-butyl)-3-nitroazetidin-3-yl]methan-1-ol, A3541/0150075
| Molecular Formula | C8H16N2O3 |
|---|---|
| Molecular Weight | 188.12 g/mol |
| LogP | 0.1083 |
| Topological Polar Surface Area | 66.61 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 188.11609 |
| Heavy Atoms | 13 |
| Complexity | 215.91925 |
Chemical Identifiers
| CAS Number | 158669-96-6 |
|---|---|
| SMILES | CC(C)(C)N1CC(C1)(CO)[N+](=O)[O-] |
Product Overview
(1-Tert-butyl-3-nitroazetidin-3-yl)methanol (CAS 158669-96-6), with molecular formula C8H16N2O3 and molecular weight 188.12 g/mol. IUPAC: (1-tert-butyl-3-nitroazetidin-3-yl)methanol.
Chemical Property Profile of (1-Tert-butyl-3-nitroazetidin-3-yl)methanol
Property Insights of (1-Tert-butyl-3-nitroazetidin-3-yl)methanol
The XLogP value of 0.1083 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (1-Tert-butyl-3-nitroazetidin-3-yl)methanol. The TPSA of 66.61 Ų falls within the moderate polarity range, balancing permeability and solubility for (1-Tert-butyl-3-nitroazetidin-3-yl)methanol. Following Lipinski's Rule of Five, (1-Tert-butyl-3-nitroazetidin-3-yl)methanol has 1 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 (1-Tert-butyl-3-nitroazetidin-3-yl)methanol?
The CAS number of (1-Tert-butyl-3-nitroazetidin-3-yl)methanol is 158669-96-6.
What is the molecular formula of (1-Tert-butyl-3-nitroazetidin-3-yl)methanol?
The molecular formula of (1-Tert-butyl-3-nitroazetidin-3-yl)methanol is C8H16N2O3.
What is the molecular weight of (1-Tert-butyl-3-nitroazetidin-3-yl)methanol?
The molecular weight of (1-Tert-butyl-3-nitroazetidin-3-yl)methanol is 188.12 g/mol.
Where can I buy (1-Tert-butyl-3-nitroazetidin-3-yl)methanol?
You can request a quote for (1-Tert-butyl-3-nitroazetidin-3-yl)methanol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (1-Tert-butyl-3-nitroazetidin-3-yl)methanol?
Yes, KEHONG BIO provides custom synthesis services for (1-Tert-butyl-3-nitroazetidin-3-yl)methanol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.