Pivaloyl nitrone
TL;DR: Pivaloyl nitrone (CAS 90656-62-5) is a chemical compound with molecular formula C6H11NO2 and molecular weight 129.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-hydroxyimino-3,3-dimethylbutan-2-one
Also Known As: pivaloyl nitrone, 3,3-Dimethyl-2-oxobutanal 1-oxime, 3,3-Dimethylbutan-1,2-dione oxime, Butanal, 3,3-dimethyl-2-oxo-, 1-oxime, (E)-, BUTANAL, 3,3-DIMETHYL-2-OXO-, 1-OXIME
| Molecular Formula | C6H11NO2 |
|---|---|
| Molecular Weight | 129.08 g/mol |
| LogP | 1.0616 |
| Topological Polar Surface Area | 49.66 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 129.07898 |
| Heavy Atoms | 9 |
| Complexity | 132.4835 |
Chemical Identifiers
| CAS Number | 90656-62-5 |
|---|---|
| SMILES | CC(C)(C)C(=O)C=NO |
Product Overview
Pivaloyl nitrone (CAS 90656-62-5), with molecular formula C6H11NO2 and molecular weight 129.08 g/mol. IUPAC: 1-hydroxyimino-3,3-dimethylbutan-2-one.
Chemical Property Profile of Pivaloyl nitrone
Property Insights of Pivaloyl nitrone
The XLogP value of 1.0616 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Pivaloyl nitrone. With a topological polar surface area (TPSA) of 49.66 Ų, Pivaloyl nitrone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Pivaloyl nitrone has 1 hydrogen bond donor(s) and 3 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 Pivaloyl nitrone?
The CAS number of Pivaloyl nitrone is 90656-62-5.
What is the molecular formula of Pivaloyl nitrone?
The molecular formula of Pivaloyl nitrone is C6H11NO2.
What is the molecular weight of Pivaloyl nitrone?
The molecular weight of Pivaloyl nitrone is 129.08 g/mol.
Where can I buy Pivaloyl nitrone?
You can request a quote for Pivaloyl nitrone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Pivaloyl nitrone?
Yes, KEHONG BIO provides custom synthesis services for Pivaloyl nitrone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.