2-Propanone, 1-(4-methoxyphenyl)-, oxime
TL;DR: 2-Propanone, 1-(4-methoxyphenyl)-, oxime (CAS 52271-41-7) is a chemical compound with molecular formula C10H13NO2 and molecular weight 179.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[1-(4-methoxyphenyl)propan-2-ylidene]hydroxylamine
Also Known As: 4-methoxyphenylacetone oxime, 2-Propanone, 1-(4-methoxyphenyl)-, oxime, 1-(4-Methoxyphenyl)acetoneoxime, 1-(p-Methoxyphenyl)-2-propanone oxime, 1-(4-methoxyphenyl)propan-2-one oxime
| Molecular Formula | C10H13NO2 |
|---|---|
| Molecular Weight | 179.09 g/mol |
| LogP | 1.8 |
| Topological Polar Surface Area | 41.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 179.09464 |
| Heavy Atoms | 13 |
| Complexity | 172.0 |
Chemical Identifiers
| CAS Number | 52271-41-7 |
|---|---|
| SMILES | CC(=NO)CC1=CC=C(C=C1)OC |
| InChIKey | XCAWVHHYSAGLPZ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-Propanone, 1-(4-methoxyphenyl)-, oxime (CAS 52271-41-7), with molecular formula C10H13NO2 and molecular weight 179.09 g/mol. IUPAC: N-[1-(4-methoxyphenyl)propan-2-ylidene]hydroxylamine.
Chemical Property Profile of 2-Propanone, 1-(4-methoxyphenyl)-, oxime
Property Insights of 2-Propanone, 1-(4-methoxyphenyl)-, oxime
The XLogP value of 1.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Propanone, 1-(4-methoxyphenyl)-, oxime. With a topological polar surface area (TPSA) of 41.8 Ų, 2-Propanone, 1-(4-methoxyphenyl)-, oxime exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Propanone, 1-(4-methoxyphenyl)-, oxime has 1 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-(4-methoxyphenyl)-, oxime?
The CAS number of 2-Propanone, 1-(4-methoxyphenyl)-, oxime is 52271-41-7.
What is the molecular formula of 2-Propanone, 1-(4-methoxyphenyl)-, oxime?
The molecular formula of 2-Propanone, 1-(4-methoxyphenyl)-, oxime is C10H13NO2.
What is the molecular weight of 2-Propanone, 1-(4-methoxyphenyl)-, oxime?
The molecular weight of 2-Propanone, 1-(4-methoxyphenyl)-, oxime is 179.09 g/mol.
Where can I buy 2-Propanone, 1-(4-methoxyphenyl)-, oxime?
You can request a quote for 2-Propanone, 1-(4-methoxyphenyl)-, oxime 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-(4-methoxyphenyl)-, oxime?
Yes, KEHONG BIO provides custom synthesis services for 2-Propanone, 1-(4-methoxyphenyl)-, oxime and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.