Introduction：Basic information about CAS 878671-99-9|Methyl 2-(5-bromo-4-(4-cyclopropylnaphthalen-1-yl)-4H-1,2,4-triazol-3-ylthio)acetate, including its chemical name, molecular formula, synonyms, physicochemical properties, and safety information, etc.
| Common Name | Methyl 2-(5-bromo-4-(4-cyclopropylnaphthalen-1-yl)-4H-1,2,4-triazol-3-ylthio)acetate |
|---|
| CAS Number | 878671-99-9 | Molecular Weight | 418.307 |
|---|
| Density | 1.6±0.1 g/cm3 | Boiling Point | 589.2±60.0 °C at 760 mmHg |
|---|
| Molecular Formula | C18H16BrN3O2S | Melting Point | / |
|---|
| MSDS | / | Flash Point | 310.1±32.9 °C |
|---|
Names
| Name | Methyl {[5-bromo-4-(4-cyclopropyl-1-naphthyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetate |
|---|
| Synonym | More Synonyms |
|---|
Chemical & Physical Properties
| Density | 1.6±0.1 g/cm3 |
|---|
| Boiling Point | 589.2±60.0 °C at 760 mmHg |
|---|
| Molecular Formula | C18H16BrN3O2S |
|---|
| Molecular Weight | 418.307 |
|---|
| Flash Point | 310.1±32.9 °C |
|---|
| Exact Mass | 417.014648 |
|---|
| LogP | 6.42 |
|---|
| Vapour Pressure | 0.0±1.7 mmHg at 25°C |
|---|
| Index of Refraction | 1.727 |
|---|
| InChIKey | OVYPPWNJXUSRPH-UHFFFAOYSA-N |
|---|
| SMILES | COC(=O)CSc1nnc(Br)n1-c1ccc(C2CC2)c2ccccc12 |
|---|
| Water Solubility | Insuluble (9.2E-5 g/L) (25 ºC) |
|---|
Synonyms
| Methyl {[5-bromo-4-(4-cyclopropyl-1-naphthyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetate |
| Acetic acid, 2-[[5-bromo-4-(4-cyclopropyl-1-naphthalenyl)-4H-1,2,4-triazol-3-yl]thio]-, methyl ester |
| Methyl 2-[[5-bromo-4-(4-cyclopropylnaphthalen-1-yl)-4H-1,2,4-triazol-3-yl]thio]acetate |
