1-(2,5-Dimethoxy-4-methylphenyl)-2-propanone oxime
TL;DR: 1-(2,5-Dimethoxy-4-methylphenyl)-2-propanone oxime (CAS 43021-99-4) is a chemical compound with molecular formula C12H17NO3 and molecular weight 223.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[1-(2,5-dimethoxy-4-methylphenyl)propan-2-ylidene]hydroxylamine
Also Known As: 1-(2,5-Dimethoxy-4-methylphenyl)-2-propanone oxime, 2-Propanone, 1-(2,5-dimethoxy-4-methylphenyl)-, oxime, (E)-1-(2,5-dimethoxy-4-methylphenyl)propan-2-one Oxime
| Molecular Formula | C12H17NO3 |
|---|---|
| Molecular Weight | 223.12 g/mol |
| LogP | 2.1 |
| Topological Polar Surface Area | 51.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 223.12085 |
| Heavy Atoms | 16 |
| Complexity | 242.0 |
Chemical Identifiers
| CAS Number | 43021-99-4 |
|---|---|
| SMILES | CC1=CC(=C(C=C1OC)CC(=NO)C)OC |
| InChIKey | HVCJKHJIAUAVFJ-UHFFFAOYSA-N |
Product Overview
1-(2,5-Dimethoxy-4-methylphenyl)-2-propanone oxime (CAS 43021-99-4), with molecular formula C12H17NO3 and molecular weight 223.12 g/mol. IUPAC: N-[1-(2,5-dimethoxy-4-methylphenyl)propan-2-ylidene]hydroxylamine.
Chemical Property Profile of 1-(2,5-Dimethoxy-4-methylphenyl)-2-propanone oxime
Property Insights of 1-(2,5-Dimethoxy-4-methylphenyl)-2-propanone oxime
The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(2,5-Dimethoxy-4-methylphenyl)-2-propanone oxime. With a topological polar surface area (TPSA) of 51.1 Ų, 1-(2,5-Dimethoxy-4-methylphenyl)-2-propanone oxime exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(2,5-Dimethoxy-4-methylphenyl)-2-propanone oxime has 1 hydrogen bond donor(s) and 4 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-(2,5-Dimethoxy-4-methylphenyl)-2-propanone oxime?
The CAS number of 1-(2,5-Dimethoxy-4-methylphenyl)-2-propanone oxime is 43021-99-4.
What is the molecular formula of 1-(2,5-Dimethoxy-4-methylphenyl)-2-propanone oxime?
The molecular formula of 1-(2,5-Dimethoxy-4-methylphenyl)-2-propanone oxime is C12H17NO3.
What is the molecular weight of 1-(2,5-Dimethoxy-4-methylphenyl)-2-propanone oxime?
The molecular weight of 1-(2,5-Dimethoxy-4-methylphenyl)-2-propanone oxime is 223.12 g/mol.
Where can I buy 1-(2,5-Dimethoxy-4-methylphenyl)-2-propanone oxime?
You can request a quote for 1-(2,5-Dimethoxy-4-methylphenyl)-2-propanone oxime directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(2,5-Dimethoxy-4-methylphenyl)-2-propanone oxime?
Yes, KEHONG BIO provides custom synthesis services for 1-(2,5-Dimethoxy-4-methylphenyl)-2-propanone oxime and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.