Propanal, 2-methyl-, oxime
TL;DR: Propanal, 2-methyl-, oxime (CAS 151-00-8) is a chemical compound with molecular formula C4H9NO and molecular weight 87.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(2-methylpropylidene)hydroxylamine
Also Known As: Isobutyraldehyde oxime, Isobutyraldoxime, Isobutanal oxime, Isobutylaldoxime, 2-Methylpropanal oxime
| Molecular Formula | C4H9NO |
|---|---|
| Molecular Weight | 87.07 g/mol |
| LogP | 1.0 |
| Topological Polar Surface Area | 32.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 87.06841 |
| Heavy Atoms | 6 |
| Complexity | 49.0 |
Chemical Identifiers
| CAS Number | 151-00-8 |
|---|---|
| SMILES | CC(C)C=NO |
| InChIKey | SYJPAKDNFZLSMV-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 20 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Propanal, 2-methyl-, oxime (CAS 151-00-8), with molecular formula C4H9NO and molecular weight 87.07 g/mol. IUPAC: N-(2-methylpropylidene)hydroxylamine.
Chemical Property Profile of Propanal, 2-methyl-, oxime
Property Insights of Propanal, 2-methyl-, oxime
The XLogP value of 1.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Propanal, 2-methyl-, oxime. With a topological polar surface area (TPSA) of 32.6 Ų, Propanal, 2-methyl-, oxime exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Propanal, 2-methyl-, 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 Propanal, 2-methyl-, oxime?
The CAS number of Propanal, 2-methyl-, oxime is 151-00-8.
What is the molecular formula of Propanal, 2-methyl-, oxime?
The molecular formula of Propanal, 2-methyl-, oxime is C4H9NO.
What is the molecular weight of Propanal, 2-methyl-, oxime?
The molecular weight of Propanal, 2-methyl-, oxime is 87.07 g/mol.
Where can I buy Propanal, 2-methyl-, oxime?
You can request a quote for Propanal, 2-methyl-, oxime directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Propanal, 2-methyl-, oxime?
Yes, KEHONG BIO provides custom synthesis services for Propanal, 2-methyl-, oxime and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.