Ethanone, 1-(3,4-dimethylphenyl)-, oxime
TL;DR: Ethanone, 1-(3,4-dimethylphenyl)-, oxime (CAS 91817-69-5) 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-[1-(3,4-dimethylphenyl)ethylidene]hydroxylamine
Also Known As: Ethanone, 1-(3,4-dimethylphenyl)-, oxime, 1-(3,4-dimethylphenyl)ethanone oxime, Ethanone,1-(3,4-dimethylphenyl)-,oxime, N-[1-(3,4-dimethylphenyl)ethylidene]hydroxylamine, (1E)-1-(3,4-dimethylphenyl)ethanone oxime
| Molecular Formula | C10H13NO |
|---|---|
| Molecular Weight | 163.10 g/mol |
| LogP | 2.50164 |
| Topological Polar Surface Area | 32.59 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 163.09972 |
| Heavy Atoms | 12 |
| Complexity | 315.61465 |
Chemical Identifiers
| CAS Number | 91817-69-5 |
|---|---|
| SMILES | CC1=C(C=C(C=C1)C(=NO)C)C |
Product Overview
Ethanone, 1-(3,4-dimethylphenyl)-, oxime (CAS 91817-69-5), with molecular formula C10H13NO and molecular weight 163.10 g/mol. IUPAC: N-[1-(3,4-dimethylphenyl)ethylidene]hydroxylamine.
Chemical Property Profile of Ethanone, 1-(3,4-dimethylphenyl)-, oxime
Property Insights of Ethanone, 1-(3,4-dimethylphenyl)-, oxime
The XLogP value of 2.50164 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethanone, 1-(3,4-dimethylphenyl)-, oxime. With a topological polar surface area (TPSA) of 32.59 Ų, Ethanone, 1-(3,4-dimethylphenyl)-, oxime exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ethanone, 1-(3,4-dimethylphenyl)-, 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 Ethanone, 1-(3,4-dimethylphenyl)-, oxime?
The CAS number of Ethanone, 1-(3,4-dimethylphenyl)-, oxime is 91817-69-5.
What is the molecular formula of Ethanone, 1-(3,4-dimethylphenyl)-, oxime?
The molecular formula of Ethanone, 1-(3,4-dimethylphenyl)-, oxime is C10H13NO.
What is the molecular weight of Ethanone, 1-(3,4-dimethylphenyl)-, oxime?
The molecular weight of Ethanone, 1-(3,4-dimethylphenyl)-, oxime is 163.10 g/mol.
Where can I buy Ethanone, 1-(3,4-dimethylphenyl)-, oxime?
You can request a quote for Ethanone, 1-(3,4-dimethylphenyl)-, oxime directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethanone, 1-(3,4-dimethylphenyl)-, oxime?
Yes, KEHONG BIO provides custom synthesis services for Ethanone, 1-(3,4-dimethylphenyl)-, oxime and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.