1-Propanone, 2-methyl-1-phenyl-, oxime
TL;DR: 1-Propanone, 2-methyl-1-phenyl-, oxime (CAS 6668-39-9) is a chemical compound with molecular formula C10H13NO and molecular weight 163.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(2-methyl-1-phenylpropylidene)hydroxylamine
Also Known As: Isobutyrophenon-oxim, isopropyl phenyl ketoxime, Maybridge4_002873, 1-Propanone, 2-methyl-1-phenyl-, oxime, N-(2-methyl-1-phenylpropylidene)hydroxylamine
| Molecular Formula | C10H13NO |
|---|---|
| Molecular Weight | 163.10 g/mol |
| LogP | 2.9 |
| Topological Polar Surface Area | 32.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 163.09972 |
| Heavy Atoms | 12 |
| Complexity | 157.0 |
Chemical Identifiers
| CAS Number | 6668-39-9 |
|---|---|
| SMILES | CC(C)C(=NO)C1=CC=CC=C1 |
| InChIKey | XGGRPWHGTGIDPM-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 6 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1-Propanone, 2-methyl-1-phenyl-, oxime (CAS 6668-39-9), with molecular formula C10H13NO and molecular weight 163.10 g/mol. IUPAC: N-(2-methyl-1-phenylpropylidene)hydroxylamine.
Chemical Property Profile of 1-Propanone, 2-methyl-1-phenyl-, oxime
Property Insights of 1-Propanone, 2-methyl-1-phenyl-, oxime
The XLogP value of 2.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Propanone, 2-methyl-1-phenyl-, oxime. With a topological polar surface area (TPSA) of 32.6 Ų, 1-Propanone, 2-methyl-1-phenyl-, oxime exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Propanone, 2-methyl-1-phenyl-, oxime has 1 hydrogen bond donor(s) and 2 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-Propanone, 2-methyl-1-phenyl-, oxime?
The CAS number of 1-Propanone, 2-methyl-1-phenyl-, oxime is 6668-39-9.
What is the molecular formula of 1-Propanone, 2-methyl-1-phenyl-, oxime?
The molecular formula of 1-Propanone, 2-methyl-1-phenyl-, oxime is C10H13NO.
What is the molecular weight of 1-Propanone, 2-methyl-1-phenyl-, oxime?
The molecular weight of 1-Propanone, 2-methyl-1-phenyl-, oxime is 163.10 g/mol.
Where can I buy 1-Propanone, 2-methyl-1-phenyl-, oxime?
You can request a quote for 1-Propanone, 2-methyl-1-phenyl-, oxime directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Propanone, 2-methyl-1-phenyl-, oxime?
Yes, KEHONG BIO provides custom synthesis services for 1-Propanone, 2-methyl-1-phenyl-, oxime and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.