2-Butanone, 4-phenyl-, oxime, (E)-
TL;DR: 2-Butanone, 4-phenyl-, oxime, (E)- (CAS 6944-54-3) 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.
N-(4-phenylbutan-2-ylidene)hydroxylamine
Also Known As: 1-phenyl-3-butoxime,, 4-phenyl-2-butoxime,, 4-phenyl-butan-2-one oxime, 2-Butanone, 4-phenyl-, oxime, (E)-, 2-Butanone, 4-phenyl-, oxime
| Molecular Formula | C10H13NO |
|---|---|
| Molecular Weight | 163.10 g/mol |
| LogP | 2.1 |
| Topological Polar Surface Area | 32.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 163.09972 |
| Heavy Atoms | 12 |
| Complexity | 148.0 |
Chemical Identifiers
| CAS Number | 6944-54-3 |
|---|---|
| SMILES | CC(=NO)CCC1=CC=CC=C1 |
| InChIKey | FTYXDGNSLZMOQY-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-Butanone, 4-phenyl-, oxime, (E)- (CAS 6944-54-3), with molecular formula C10H13NO and molecular weight 163.10 g/mol. IUPAC: N-(4-phenylbutan-2-ylidene)hydroxylamine.
Chemical Property Profile of 2-Butanone, 4-phenyl-, oxime, (E)-
Property Insights of 2-Butanone, 4-phenyl-, oxime, (E)-
The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Butanone, 4-phenyl-, oxime, (E)-. With a topological polar surface area (TPSA) of 32.6 Ų, 2-Butanone, 4-phenyl-, oxime, (E)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Butanone, 4-phenyl-, oxime, (E)- 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 2-Butanone, 4-phenyl-, oxime, (E)-?
The CAS number of 2-Butanone, 4-phenyl-, oxime, (E)- is 6944-54-3.
What is the molecular formula of 2-Butanone, 4-phenyl-, oxime, (E)-?
The molecular formula of 2-Butanone, 4-phenyl-, oxime, (E)- is C10H13NO.
What is the molecular weight of 2-Butanone, 4-phenyl-, oxime, (E)-?
The molecular weight of 2-Butanone, 4-phenyl-, oxime, (E)- is 163.10 g/mol.
Where can I buy 2-Butanone, 4-phenyl-, oxime, (E)-?
You can request a quote for 2-Butanone, 4-phenyl-, oxime, (E)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Butanone, 4-phenyl-, oxime, (E)-?
Yes, KEHONG BIO provides custom synthesis services for 2-Butanone, 4-phenyl-, oxime, (E)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.