2-Propanone, 1-nitro-
TL;DR: 2-Propanone, 1-nitro- (CAS 10230-68-9) is a chemical compound with molecular formula C3H5NO3 and molecular weight 103.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-nitropropan-2-one
Also Known As: 1-nitropropan-2-one, Nitroacetone, 2-Propanone, 1-nitro-, 1-Nitro-2-propanone, Nitropropanone
| Molecular Formula | C3H5NO3 |
|---|---|
| Molecular Weight | 103.03 g/mol |
| LogP | -0.1 |
| Topological Polar Surface Area | 62.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 103.02694 |
| Heavy Atoms | 7 |
| Complexity | 92.0 |
Chemical Identifiers
| CAS Number | 10230-68-9 |
|---|---|
| SMILES | CC(=O)C[N+](=O)[O-] |
| InChIKey | QCDJOJKIHZQJGX-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 11 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-Propanone, 1-nitro- (CAS 10230-68-9), with molecular formula C3H5NO3 and molecular weight 103.03 g/mol. IUPAC: 1-nitropropan-2-one.
Chemical Property Profile of 2-Propanone, 1-nitro-
Property Insights of 2-Propanone, 1-nitro-
The XLogP value of -0.1 indicates that 2-Propanone, 1-nitro- is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 62.9 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Propanone, 1-nitro-. Following Lipinski's Rule of Five, 2-Propanone, 1-nitro- has 0 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 2-Propanone, 1-nitro-?
The CAS number of 2-Propanone, 1-nitro- is 10230-68-9.
What is the molecular formula of 2-Propanone, 1-nitro-?
The molecular formula of 2-Propanone, 1-nitro- is C3H5NO3.
What is the molecular weight of 2-Propanone, 1-nitro-?
The molecular weight of 2-Propanone, 1-nitro- is 103.03 g/mol.
Where can I buy 2-Propanone, 1-nitro-?
You can request a quote for 2-Propanone, 1-nitro- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Propanone, 1-nitro-?
Yes, KEHONG BIO provides custom synthesis services for 2-Propanone, 1-nitro- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.