1-[4-(methoxyiminomethyl)phenoxy]-3,3-dimethyl-2-(1,2,4-triazol-1-ylmethyl)butan-2-ol
TL;DR: 1-[4-(methoxyiminomethyl)phenoxy]-3,3-dimethyl-2-(1,2,4-triazol-1-ylmethyl)butan-2-ol (CAS 92929-94-7) is a chemical compound with molecular formula C17H24N4O3 and molecular weight 332.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[4-(methoxyiminomethyl)phenoxy]-3,3-dimethyl-2-(1,2,4-triazol-1-ylmethyl)butan-2-ol
Also Known As: Benzaldehyde, 4-(2-hydroxy-3,3-dimethyl-2-(1H-1,2,4-triazol-1-ylmethyl)butoxy)-, O-methyloxime
| Molecular Formula | C17H24N4O3 |
|---|---|
| Molecular Weight | 332.18 g/mol |
| LogP | 2.6 |
| Topological Polar Surface Area | 81.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 8 |
| Exact Mass | 332.18484 |
| Heavy Atoms | 24 |
| Complexity | 405.0 |
Chemical Identifiers
| CAS Number | 92929-94-7 |
|---|---|
| SMILES | CC(C)(C)C(CN1C=NC=N1)(COC2=CC=C(C=C2)C=NOC)O |
| InChIKey | ARVBIHYXZWVWQZ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1-[4-(methoxyiminomethyl)phenoxy]-3,3-dimethyl-2-(1,2,4-triazol-1-ylmethyl)butan-2-ol (CAS 92929-94-7), with molecular formula C17H24N4O3 and molecular weight 332.18 g/mol. IUPAC: 1-[4-(methoxyiminomethyl)phenoxy]-3,3-dimethyl-2-(1,2,4-triazol-1-ylmethyl)butan-2-ol.
Chemical Property Profile of 1-[4-(methoxyiminomethyl)phenoxy]-3,3-dimethyl-2-(1,2,4-triazol-1-ylmethyl)butan-2-ol
Property Insights of 1-[4-(methoxyiminomethyl)phenoxy]-3,3-dimethyl-2-(1,2,4-triazol-1-ylmethyl)butan-2-ol
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-[4-(methoxyiminomethyl)phenoxy]-3,3-dimethyl-2-(1,2,4-triazol-1-ylmethyl)butan-2-ol. The TPSA of 81.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-[4-(methoxyiminomethyl)phenoxy]-3,3-dimethyl-2-(1,2,4-triazol-1-ylmethyl)butan-2-ol. Following Lipinski's Rule of Five, 1-[4-(methoxyiminomethyl)phenoxy]-3,3-dimethyl-2-(1,2,4-triazol-1-ylmethyl)butan-2-ol has 1 hydrogen bond donor(s) and 6 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 1-[4-(methoxyiminomethyl)phenoxy]-3,3-dimethyl-2-(1,2,4-triazol-1-ylmethyl)butan-2-ol?
The CAS number of 1-[4-(methoxyiminomethyl)phenoxy]-3,3-dimethyl-2-(1,2,4-triazol-1-ylmethyl)butan-2-ol is 92929-94-7.
What is the molecular formula of 1-[4-(methoxyiminomethyl)phenoxy]-3,3-dimethyl-2-(1,2,4-triazol-1-ylmethyl)butan-2-ol?
The molecular formula of 1-[4-(methoxyiminomethyl)phenoxy]-3,3-dimethyl-2-(1,2,4-triazol-1-ylmethyl)butan-2-ol is C17H24N4O3.
What is the molecular weight of 1-[4-(methoxyiminomethyl)phenoxy]-3,3-dimethyl-2-(1,2,4-triazol-1-ylmethyl)butan-2-ol?
The molecular weight of 1-[4-(methoxyiminomethyl)phenoxy]-3,3-dimethyl-2-(1,2,4-triazol-1-ylmethyl)butan-2-ol is 332.18 g/mol.
Where can I buy 1-[4-(methoxyiminomethyl)phenoxy]-3,3-dimethyl-2-(1,2,4-triazol-1-ylmethyl)butan-2-ol?
You can request a quote for 1-[4-(methoxyiminomethyl)phenoxy]-3,3-dimethyl-2-(1,2,4-triazol-1-ylmethyl)butan-2-ol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-[4-(methoxyiminomethyl)phenoxy]-3,3-dimethyl-2-(1,2,4-triazol-1-ylmethyl)butan-2-ol?
Yes, KEHONG BIO provides custom synthesis services for 1-[4-(methoxyiminomethyl)phenoxy]-3,3-dimethyl-2-(1,2,4-triazol-1-ylmethyl)butan-2-ol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.