4-Methoxyimino-3-phenylbutan-2-one
TL;DR: 4-Methoxyimino-3-phenylbutan-2-one (CAS 339111-36-3) is a chemical compound with molecular formula C11H13NO2 and molecular weight 191.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-methoxyimino-3-phenylbutan-2-one
Also Known As: 4-methoxyimino-3-phenylbutan-2-one, 3-oxo-2-phenylbutanal O-methyloxime, 4-methoxyimino-3-phenyl-butan-2-one
| Molecular Formula | C11H13NO2 |
|---|---|
| Molecular Weight | 191.09 g/mol |
| LogP | 1.9914 |
| Topological Polar Surface Area | 38.66 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 191.09464 |
| Heavy Atoms | 14 |
| Complexity | 319.31924 |
Chemical Identifiers
| CAS Number | 339111-36-3 |
|---|---|
| SMILES | CC(=O)C(C=NOC)C1=CC=CC=C1 |
Product Overview
4-Methoxyimino-3-phenylbutan-2-one (CAS 339111-36-3), with molecular formula C11H13NO2 and molecular weight 191.09 g/mol. IUPAC: 4-methoxyimino-3-phenylbutan-2-one.
Chemical Property Profile of 4-Methoxyimino-3-phenylbutan-2-one
Property Insights of 4-Methoxyimino-3-phenylbutan-2-one
The XLogP value of 1.9914 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-Methoxyimino-3-phenylbutan-2-one. With a topological polar surface area (TPSA) of 38.66 Ų, 4-Methoxyimino-3-phenylbutan-2-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Methoxyimino-3-phenylbutan-2-one has 0 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 4-Methoxyimino-3-phenylbutan-2-one?
The CAS number of 4-Methoxyimino-3-phenylbutan-2-one is 339111-36-3.
What is the molecular formula of 4-Methoxyimino-3-phenylbutan-2-one?
The molecular formula of 4-Methoxyimino-3-phenylbutan-2-one is C11H13NO2.
What is the molecular weight of 4-Methoxyimino-3-phenylbutan-2-one?
The molecular weight of 4-Methoxyimino-3-phenylbutan-2-one is 191.09 g/mol.
Where can I buy 4-Methoxyimino-3-phenylbutan-2-one?
You can request a quote for 4-Methoxyimino-3-phenylbutan-2-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Methoxyimino-3-phenylbutan-2-one?
Yes, KEHONG BIO provides custom synthesis services for 4-Methoxyimino-3-phenylbutan-2-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.