(1E)-2-methyl-1-phenyl-1-propanone oxime
TL;DR: (1E)-2-methyl-1-phenyl-1-propanone oxime (CAS 72846-70-9) 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.
(NE)-N-(2-methyl-1-phenylpropylidene)hydroxylamine
Also Known As: 2-methyl-1-phenyl-propan-1-one oxime, (1E)-2-methyl-1-phenyl-1-propanone oxime, (NE)-N-(2-methyl-1-phenylpropylidene)hydroxylamine
| Molecular Formula | C10H13NO |
|---|---|
| Molecular Weight | 163.10 g/mol |
| LogP | 2.5209 |
| Topological Polar Surface Area | 32.59 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 163.09972 |
| Heavy Atoms | 12 |
| Complexity | 264.42688 |
Chemical Identifiers
| CAS Number | 72846-70-9 |
|---|---|
| SMILES | CC(C)/C(=N\O)/C1=CC=CC=C1 |
Product Overview
(1E)-2-methyl-1-phenyl-1-propanone oxime (CAS 72846-70-9), with molecular formula C10H13NO and molecular weight 163.10 g/mol. IUPAC: (NE)-N-(2-methyl-1-phenylpropylidene)hydroxylamine.
Chemical Property Profile of (1E)-2-methyl-1-phenyl-1-propanone oxime
Property Insights of (1E)-2-methyl-1-phenyl-1-propanone oxime
The XLogP value of 2.5209 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (1E)-2-methyl-1-phenyl-1-propanone oxime. With a topological polar surface area (TPSA) of 32.59 Ų, (1E)-2-methyl-1-phenyl-1-propanone oxime exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (1E)-2-methyl-1-phenyl-1-propanone 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 (1E)-2-methyl-1-phenyl-1-propanone oxime?
The CAS number of (1E)-2-methyl-1-phenyl-1-propanone oxime is 72846-70-9.
What is the molecular formula of (1E)-2-methyl-1-phenyl-1-propanone oxime?
The molecular formula of (1E)-2-methyl-1-phenyl-1-propanone oxime is C10H13NO.
What is the molecular weight of (1E)-2-methyl-1-phenyl-1-propanone oxime?
The molecular weight of (1E)-2-methyl-1-phenyl-1-propanone oxime is 163.10 g/mol.
Where can I buy (1E)-2-methyl-1-phenyl-1-propanone oxime?
You can request a quote for (1E)-2-methyl-1-phenyl-1-propanone oxime directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (1E)-2-methyl-1-phenyl-1-propanone oxime?
Yes, KEHONG BIO provides custom synthesis services for (1E)-2-methyl-1-phenyl-1-propanone oxime and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.