1-(1,1,2,2-Tetrafluoro-2-methoxycarbonylethyl)-4,5-bis(methoxycarbonyl)-1,2,3-triazole
TL;DR: 1-(1,1,2,2-Tetrafluoro-2-methoxycarbonylethyl)-4,5-bis(methoxycarbonyl)-1,2,3-triazole (CAS 307929-66-4) is a chemical compound with molecular formula C10H9F4N3O6 and molecular weight 343.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
dimethyl 1-(1,1,2,2-tetrafluoro-3-methoxy-3-oxopropyl)triazole-4,5-dicarboxylate
Also Known As: 1-(1,1,2,2-Tetrafluoro-2-methoxycarbonylethyl)-4,5-bis(methoxycarbonyl)-1,2,3-triazole, 1-(2-Methoxycarbonylperfluoroethyl)-4,5-bis(methoxycarbonyl)-1,2,3-triazole, dimethyl 1-(1,1,2,2-tetrafluoro-3-methoxy-3-oxopropyl)triazole-4,5-dicarboxylate, Dimethyl 1-(1,1,2,2-tetrafluoro-3-methoxy-3-oxopropyl)-1H-1,2,3-triazole-4,5-dicarboxylate, Dimethyl 1-(1,1,2,2-tetrafluoro-3-methoxy-3-oxopropyl)-1H-1,2,3-triazole-4,5-dicarboxylate #
| Molecular Formula | C10H9F4N3O6 |
|---|---|
| Molecular Weight | 343.04 g/mol |
| LogP | 1.3 |
| Topological Polar Surface Area | 110.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 12 |
| Rotatable Bonds | 8 |
| Exact Mass | 343.04276 |
| Heavy Atoms | 23 |
| Complexity | 503.0 |
Chemical Identifiers
| CAS Number | 307929-66-4 |
|---|---|
| SMILES | COC(=O)C1=C(N(N=N1)C(C(C(=O)OC)(F)F)(F)F)C(=O)OC |
| InChIKey | DVBCMXGMMOQAKV-UHFFFAOYSA-N |
Product Overview
1-(1,1,2,2-Tetrafluoro-2-methoxycarbonylethyl)-4,5-bis(methoxycarbonyl)-1,2,3-triazole (CAS 307929-66-4), with molecular formula C10H9F4N3O6 and molecular weight 343.04 g/mol. IUPAC: dimethyl 1-(1,1,2,2-tetrafluoro-3-methoxy-3-oxopropyl)triazole-4,5-dicarboxylate.
Chemical Property Profile of 1-(1,1,2,2-Tetrafluoro-2-methoxycarbonylethyl)-4,5-bis(methoxycarbonyl)-1,2,3-triazole
Property Insights of 1-(1,1,2,2-Tetrafluoro-2-methoxycarbonylethyl)-4,5-bis(methoxycarbonyl)-1,2,3-triazole
The XLogP value of 1.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(1,1,2,2-Tetrafluoro-2-methoxycarbonylethyl)-4,5-bis(methoxycarbonyl)-1,2,3-triazole. The TPSA of 110.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(1,1,2,2-Tetrafluoro-2-methoxycarbonylethyl)-4,5-bis(methoxycarbonyl)-1,2,3-triazole. Following Lipinski's Rule of Five, 1-(1,1,2,2-Tetrafluoro-2-methoxycarbonylethyl)-4,5-bis(methoxycarbonyl)-1,2,3-triazole has 0 hydrogen bond donor(s) and 12 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 1-(1,1,2,2-Tetrafluoro-2-methoxycarbonylethyl)-4,5-bis(methoxycarbonyl)-1,2,3-triazole?
The CAS number of 1-(1,1,2,2-Tetrafluoro-2-methoxycarbonylethyl)-4,5-bis(methoxycarbonyl)-1,2,3-triazole is 307929-66-4.
What is the molecular formula of 1-(1,1,2,2-Tetrafluoro-2-methoxycarbonylethyl)-4,5-bis(methoxycarbonyl)-1,2,3-triazole?
The molecular formula of 1-(1,1,2,2-Tetrafluoro-2-methoxycarbonylethyl)-4,5-bis(methoxycarbonyl)-1,2,3-triazole is C10H9F4N3O6.
What is the molecular weight of 1-(1,1,2,2-Tetrafluoro-2-methoxycarbonylethyl)-4,5-bis(methoxycarbonyl)-1,2,3-triazole?
The molecular weight of 1-(1,1,2,2-Tetrafluoro-2-methoxycarbonylethyl)-4,5-bis(methoxycarbonyl)-1,2,3-triazole is 343.04 g/mol.
Where can I buy 1-(1,1,2,2-Tetrafluoro-2-methoxycarbonylethyl)-4,5-bis(methoxycarbonyl)-1,2,3-triazole?
You can request a quote for 1-(1,1,2,2-Tetrafluoro-2-methoxycarbonylethyl)-4,5-bis(methoxycarbonyl)-1,2,3-triazole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(1,1,2,2-Tetrafluoro-2-methoxycarbonylethyl)-4,5-bis(methoxycarbonyl)-1,2,3-triazole?
Yes, KEHONG BIO provides custom synthesis services for 1-(1,1,2,2-Tetrafluoro-2-methoxycarbonylethyl)-4,5-bis(methoxycarbonyl)-1,2,3-triazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.