Introduction：Basic information about CAS 89604-92-2|2-Mercaptobenzothiazolyl-(Z)-(2-aminothiazol-4-yl)-2-(tert-butoxycarbonyl) isopropoxy, including its chemical name, molecular formula, synonyms, physicochemical properties, and safety information, etc.
| Common Name | 2-Mercaptobenzothiazolyl-(Z)-(2-aminothiazol-4-yl)-2-(tert-butoxycarbonyl) isopropoxyiminoacetate |
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| CAS Number | 89604-92-2 | Molecular Weight | 478.608 |
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| Density | 1.4±0.1 g/cm3 | Boiling Point | 621.6±61.0 °C at 760 mmHg |
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| Molecular Formula | C20H22N4O4S3 | Melting Point | 138-140ºC |
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| MSDS | / | Flash Point | 329.7±33.2 °C |
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Names
| Name | 2-Mercaptobenzothiazolyl-(Z)-(2-aminothiazol-4-yl)-2-(tert-butoxycarbonyl) isopropoxyiminoacetate |
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| Synonym | More Synonyms |
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Chemical & Physical Properties
| Density | 1.4±0.1 g/cm3 |
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| Boiling Point | 621.6±61.0 °C at 760 mmHg |
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| Melting Point | 138-140ºC |
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| Molecular Formula | C20H22N4O4S3 |
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| Molecular Weight | 478.608 |
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| Flash Point | 329.7±33.2 °C |
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| Exact Mass | 478.080322 |
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| PSA | 198.54000 |
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| LogP | 5.65 |
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| Vapour Pressure | 0.0±1.8 mmHg at 25°C |
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| Index of Refraction | 1.672 |
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| InChIKey | RCZJVHXVCSKDKB-OYKKKHCWSA-N |
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| SMILES | CC(C)(C)OC(=O)C(C)(C)ON=C(C(=O)Sc1nc2ccccc2s1)c1csc(N)n1 |
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| Storage condition | Hygroscopic, -20?C Freezer, Under Inert Atmosphere |
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Safety Information
| Hazard Codes | Xi |
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| Risk Phrases | R53 |
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| Safety Phrases | S61 |
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Synonyms
| EINECS 419-040-9 |
| 1,1-Dimethylethyl 2-[[[(1Z)-1-(2-amino-4-thiazolyl)-2-(2-benzothiazolylthio)-2-oxoethylidene]amino]oxy]-2-methylpropanoate |
| 2-Methyl-2-propanyl 2-({(Z)-[1-(2-amino-1,3-thiazol-4-yl)-2-(1,3-benzothiazol-2-ylsulfanyl)-2-oxoethylidene]amino}oxy)-2-methylpropanoate |
| Propanoic acid, 2-[[[(1Z)-1-(2-amino-4-thiazolyl)-2-(2-benzothiazolylthio)-2-oxoethylidene]amino]oxy]-2-methyl-, 1,1-dimethylethyl ester |
| BPTA |
| benzothiazolylthio)-2-oxoethylidene]amino]oxy]-2 |
| tert-Butyl 2-({[(1Z)-1-(2-amino-1,3-thiazol-4-yl)-2-(1,3-benzothiazol-2-ylsulfanyl)-2-oxoethylidene]amino}oxy)-2-methylpropanoate |
| T56 BN DSJ CSVYUNOX1&1&VOX1&1&1&- ET5N CSJ BZ &&Z Form |
| MFCD00071548 |
| tert-Butyl 2-({[(1Z)-1-(2-amino-1,3-thiazol-4-yl)-2-(1,3-benzothiazol-2-ylthio)-2-oxoethylidene]amino}oxy)-2-methylpropionate |
