2-{[5-(2,4-dichlorophenyl)-4-ethyl-4H-1,2,4-triazol-3-yl]sulfanyl}acetic acid
2-[[5-(2,4-dichlorophenyl)-4-ethyl-1,2,4-triazol-3-yl]sulfanyl]acetic acid
Also Known As: 2-{[5-(2,4-dichlorophenyl)-4-ethyl-4H-1,2,4-triazol-3-yl]sulfanyl}acetic acid|BAS 01290494|AG-690/13704113|2-[[5-(2,4-dichlorophenyl)-4-ethyl-1,2,4-triazol-3-yl]sulfanyl]acetic acid|{[5-(2,4-dichlorophenyl)-4-ethyl-4H-1,2,4-triazol-3-yl]thio}acetic acid|{[5-(2,4-dichlorophenyl)-4-ethyl-4H-1,2,4-triazol-3-yl]sulfanyl}acetic acid|([5-(2,4-Dichlorophenyl)-4-ethyl-4h-1,2,4-triazol-3-yl]thio)acetic acid|2-[5-(2,4-dichlorophenyl)-4-ethyl-1,2,4-triazol-3-ylthio]acetic acid|[5-(2,4-Dichloro-phenyl)-4-ethyl-4H-[1,2,4]triazol-3-ylsulfanyl]-acetic acid|2-((5-(2,4-DICHLOROPHENYL)-4-ETHYL-4H-1,2,4-TRIAZOL-3-YL)THIO)ACETIC ACID|2-{[5-(2,4-dichlorophenyl)-4-ethyl-4H-1,2,4-triazol-3-yl]sulfanyl}aceticacid
| Molecular Formula | C12H11Cl2N3O2S |
|---|---|
| Molecular Weight | 330.9949 g/mol |
| LogP | 3.1 |
| Topological Polar Surface Area | 93.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 330.9949 |
| Monoisotopic Mass | 330.9949 |
| Heavy Atoms | 20 |
| Complexity | 351.0 |
Chemical Identifiers
| CAS Number | 337487-69-1 |
|---|---|
| SMILES | CCN1C(=NN=C1SCC(=O)O)C2=C(C=C(C=C2)Cl)Cl |
| InChIKey | MMEQDLUEWRRHGK-UHFFFAOYSA-N |
Product Overview
2-{[5-(2,4-dichlorophenyl)-4-ethyl-4H-1,2,4-triazol-3-yl]sulfanyl}acetic acid (CAS 337487-69-1), with molecular formula C12H11Cl2N3O2S and molecular weight 330.9949 g/mol. IUPAC: 2-[[5-(2,4-dichlorophenyl)-4-ethyl-1,2,4-triazol-3-yl]sulfanyl]acetic acid.
2-{[5-(2,4-dichlorophenyl)-4-ethyl-4H-1,2,4-triazol-3-yl]sulfanyl}acetic acid is a custom synthesis product. We offer services from milligram to kilogram scale.
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