2-Methyl-2-nitro-1-propanol
TL;DR: 2-Methyl-2-nitro-1-propanol (CAS 76-39-1) is a chemical compound with molecular formula C4H9NO3 and molecular weight 119.05824 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-methyl-2-nitropropan-1-ol
Also Known As: 2-METHYL-2-NITRO-1-PROPANOL, 2-Methyl-2-nitropropan-1-ol, 2-Nitroisobutanol, 2-Methyl-2-nitropropanol, 2-Nitro-2-methylpropanol
Application Areas
Top 5 of 14 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C4H9NO3 |
| Molecular Weight | 119.05824 g/mol |
| XLogP | -0.1 |
| Topological Polar Surface Area (TPSA) | 66.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 119.05824 Da |
| Heavy Atoms | 8 |
| Complexity | 93.0 |
| Vapor Pressure | 0.09 [mmHg] |
| SMILES | CC(C)(CO)[N+](=O)[O-] |
| InChIKey | MVGJRISPEUZYAQ-UHFFFAOYSA-N |
Product Description
Applications: 2-Methyl-2-nitro-1-propanol is used in complex organic molecule assembly across discovery and process chemistry, as well as pharmaceutical synthesis routes and API production. It commonly serves as a versatile building block for organic synthesis. CoreyChem supplies 2-Methyl-2-nitro-1-propanol (CAS 76-39-1) with custom synthesis available from milligram to multi-kilogram scale, supported by COA, MSDS, and HPLC/NMR/MS documentation.
A organic building block supplied by CoreyChem, 2-Methyl-2-nitro-1-propanol (CAS 76-39-1) has the molecular formula C4H9NO3 and a molecular weight of 119.06 g/mol. It is also known as 2-METHYL-2-NITRO-1-PROPANOL and 2-Methyl-2-nitropropan-1-ol.
Custom synthesis and full analytical documentation (COA/MSDS) are available from CoreyChem. Request a quotation with your required quantity and purity for current lead time and pricing.
Chemical Property Profile of 2-Methyl-2-nitro-1-propanol
Property Insights of 2-Methyl-2-nitro-1-propanol
The XLogP value of -0.1 indicates that 2-Methyl-2-nitro-1-propanol is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 66.1 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Methyl-2-nitro-1-propanol. Following Lipinski's Rule of Five, 2-Methyl-2-nitro-1-propanol 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
What is the CAS number of 2-Methyl-2-nitro-1-propanol?
The CAS number of 2-Methyl-2-nitro-1-propanol is 76-39-1.
What is the molecular formula of 2-Methyl-2-nitro-1-propanol?
The molecular formula of 2-Methyl-2-nitro-1-propanol is C4H9NO3.
What is the molecular weight of 2-Methyl-2-nitro-1-propanol?
The molecular weight of 2-Methyl-2-nitro-1-propanol is 119.05824 g/mol.
What are the applications of 2-Methyl-2-nitro-1-propanol?
2-Methyl-2-nitro-1-propanol is used in complex organic molecule assembly across discovery and process chemistry, as well as pharmaceutical synthesis routes and API production. It commonly serves as a versatile building block for organic synthesis. CoreyChem supplies 2-Methyl-2-nitro-1-propanol...
Where can I buy 2-Methyl-2-nitro-1-propanol?
You can request a quote for 2-Methyl-2-nitro-1-propanol directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 2-Methyl-2-nitro-1-propanol?
Yes, CoreyChem provides custom synthesis services for 2-Methyl-2-nitro-1-propanol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.