2,4,6-Trimethylbenzaldoxime
TL;DR: 2,4,6-Trimethylbenzaldoxime (CAS 40188-34-9) 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-[(2,4,6-trimethylphenyl)methylidene]hydroxylamine
Also Known As: 2,4,6-Trimethylbenzaldoxime, 2,4,6-TRIMETHYL-BENZALDEHYDE OXIME, N-[(2,4,6-trimethylphenyl)methylidene]hydroxylamine
| Molecular Formula | C10H13NO |
|---|---|
| Molecular Weight | 163.10 g/mol |
| LogP | 2.7 |
| Topological Polar Surface Area | 32.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 163.09972 |
| Heavy Atoms | 12 |
| Complexity | 155.0 |
Chemical Identifiers
| CAS Number | 40188-34-9 |
|---|---|
| SMILES | CC1=CC(=C(C(=C1)C)C=NO)C |
| InChIKey | QYZKLTLEVQDKFJ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2,4,6-Trimethylbenzaldoxime (CAS 40188-34-9), with molecular formula C10H13NO and molecular weight 163.10 g/mol. IUPAC: N-[(2,4,6-trimethylphenyl)methylidene]hydroxylamine.
Chemical Property Profile of 2,4,6-Trimethylbenzaldoxime
Property Insights of 2,4,6-Trimethylbenzaldoxime
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2,4,6-Trimethylbenzaldoxime. With a topological polar surface area (TPSA) of 32.6 Ų, 2,4,6-Trimethylbenzaldoxime exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,4,6-Trimethylbenzaldoxime 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 2,4,6-Trimethylbenzaldoxime?
The CAS number of 2,4,6-Trimethylbenzaldoxime is 40188-34-9.
What is the molecular formula of 2,4,6-Trimethylbenzaldoxime?
The molecular formula of 2,4,6-Trimethylbenzaldoxime is C10H13NO.
What is the molecular weight of 2,4,6-Trimethylbenzaldoxime?
The molecular weight of 2,4,6-Trimethylbenzaldoxime is 163.10 g/mol.
Where can I buy 2,4,6-Trimethylbenzaldoxime?
You can request a quote for 2,4,6-Trimethylbenzaldoxime directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,4,6-Trimethylbenzaldoxime?
Yes, KEHONG BIO provides custom synthesis services for 2,4,6-Trimethylbenzaldoxime and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.