![1-[1-(3,5-dichlorophenyl)-1H-1,2,3-triazol-4-yl]-2,2-dimethoxy-1-ethanone structure](/static/products/4778/477858-60-9.webp)
1-[1-(3,5-dichlorophenyl)-1H-1,2,3-triazol-4-yl]-2,2-dimethoxy-1-ethanone
TL;DR: 1-[1-(3,5-dichlorophenyl)-1H-1,2,3-triazol-4-yl]-2,2-dimethoxy-1-ethanone (CAS 477858-60-9) is a chemical compound with molecular formula C12H11Cl2N3O3 and molecular weight 315.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[1-(3,5-dichlorophenyl)triazol-4-yl]-2,2-dimethoxyethanone
Also Known As: 1-[1-(3,5-dichlorophenyl)-1H-1,2,3-triazol-4-yl]-2,2-dimethoxy-1-ethanone, 1-[1-(3,5-dichlorophenyl)-1H-1,2,3-triazol-4-yl]-2,2-dimethoxyethan-1-one, 1-[1-(3,5-dichlorophenyl)triazol-4-yl]-2,2-dimethoxyethanone, 11P-807, 1-[1-(3,5-dichlorophenyl)triazol-4-yl]-2,2-dimethoxy-ethanone
| Molecular Formula | C12H11Cl2N3O3 |
|---|---|
| Molecular Weight | 315.02 g/mol |
| LogP | 2.3757 |
| Topological Polar Surface Area | 66.24 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 315.01776 |
| Heavy Atoms | 20 |
| Complexity | 605.91016 |
Chemical Identifiers
| CAS Number | 477858-60-9 |
|---|---|
| SMILES | COC(C(=O)C1=CN(N=N1)C2=CC(=CC(=C2)Cl)Cl)OC |
Product Overview
1-[1-(3,5-dichlorophenyl)-1H-1,2,3-triazol-4-yl]-2,2-dimethoxy-1-ethanone (CAS 477858-60-9), with molecular formula C12H11Cl2N3O3 and molecular weight 315.02 g/mol. IUPAC: 1-[1-(3,5-dichlorophenyl)triazol-4-yl]-2,2-dimethoxyethanone.
Chemical Property Profile of 1-[1-(3,5-dichlorophenyl)-1H-1,2,3-triazol-4-yl]-2,2-dimethoxy-1-ethanone
Property Insights of 1-[1-(3,5-dichlorophenyl)-1H-1,2,3-triazol-4-yl]-2,2-dimethoxy-1-ethanone
The XLogP value of 2.3757 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-[1-(3,5-dichlorophenyl)-1H-1,2,3-triazol-4-yl]-2,2-dimethoxy-1-ethanone. The TPSA of 66.24 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-[1-(3,5-dichlorophenyl)-1H-1,2,3-triazol-4-yl]-2,2-dimethoxy-1-ethanone. Following Lipinski's Rule of Five, 1-[1-(3,5-dichlorophenyl)-1H-1,2,3-triazol-4-yl]-2,2-dimethoxy-1-ethanone has 0 hydrogen bond donor(s) and 5 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-[1-(3,5-dichlorophenyl)-1H-1,2,3-triazol-4-yl]-2,2-dimethoxy-1-ethanone?
The CAS number of 1-[1-(3,5-dichlorophenyl)-1H-1,2,3-triazol-4-yl]-2,2-dimethoxy-1-ethanone is 477858-60-9.
What is the molecular formula of 1-[1-(3,5-dichlorophenyl)-1H-1,2,3-triazol-4-yl]-2,2-dimethoxy-1-ethanone?
The molecular formula of 1-[1-(3,5-dichlorophenyl)-1H-1,2,3-triazol-4-yl]-2,2-dimethoxy-1-ethanone is C12H11Cl2N3O3.
What is the molecular weight of 1-[1-(3,5-dichlorophenyl)-1H-1,2,3-triazol-4-yl]-2,2-dimethoxy-1-ethanone?
The molecular weight of 1-[1-(3,5-dichlorophenyl)-1H-1,2,3-triazol-4-yl]-2,2-dimethoxy-1-ethanone is 315.02 g/mol.
Where can I buy 1-[1-(3,5-dichlorophenyl)-1H-1,2,3-triazol-4-yl]-2,2-dimethoxy-1-ethanone?
You can request a quote for 1-[1-(3,5-dichlorophenyl)-1H-1,2,3-triazol-4-yl]-2,2-dimethoxy-1-ethanone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-[1-(3,5-dichlorophenyl)-1H-1,2,3-triazol-4-yl]-2,2-dimethoxy-1-ethanone?
Yes, KEHONG BIO provides custom synthesis services for 1-[1-(3,5-dichlorophenyl)-1H-1,2,3-triazol-4-yl]-2,2-dimethoxy-1-ethanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.