Introduction:Basic information about CAS 365996-86-7|5,7-Dihydro-2-(methylthio)-6H-pyrrolo[3,4-d]pyrimidine-6-carboxylic acid 1,1-, including its chemical name, molecular formula, synonyms, physicochemical properties, and safety information, etc.
| Common Name | 5,7-Dihydro-2-(methylthio)-6H-pyrrolo[3,4-d]pyrimidine-6-carboxylic acid 1,1-dimethylethyl ester |
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| CAS Number | 365996-86-7 | Molecular Weight | 267.347 |
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| Density | 1.26±0.1 g/cm3 | Boiling Point | 402.9±45.0 °C at 760 mmHg |
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| Molecular Formula | C12H17N3O2S | Melting Point | / |
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| MSDS | / | Flash Point | 197.4±28.7 °C |
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Names
| Name | tert-butyl 2-methylsulfanyl-5,7-dihydropyrrolo[3,4-d]pyrimidine-6-carboxylate |
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| Synonym | More Synonyms |
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Chemical & Physical Properties
| Density | 1.26±0.1 g/cm3 |
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| Boiling Point | 402.9±45.0 °C at 760 mmHg |
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| Molecular Formula | C12H17N3O2S |
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| Molecular Weight | 267.347 |
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| Flash Point | 197.4±28.7 °C |
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| Exact Mass | 267.104156 |
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| PSA | 80.62000 |
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| LogP | 1.24 |
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| Vapour Pressure | 0.0±0.9 mmHg at 25°C |
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| Index of Refraction | 1.586 |
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| InChIKey | WYPNWMDBICFBAM-UHFFFAOYSA-N |
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| SMILES | CSc1ncc2c(n1)CN(C(=O)OC(C)(C)C)C2 |
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| Water Solubility | Very slightly soluble (0.32 g/L) (25 ºC) |
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Safety Information
Customs
| HS Code | 2933990090 |
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| Summary | 2933990090. heterocyclic compounds with nitrogen hetero-atom(s) only. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0% |
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Synonyms
| 6H-Pyrrolo[3,4-d]pyrimidine-6-carboxylic acid, 5,7-dihydro-2-(methylthio)-, 1,1-dimethylethyl ester |
| tert-butyl 2-(methylthio)-5,7-dihydro-6H-pyrrolo[3,4-d]pyrimidine-6-carboxylate |
| TERT-BUTYL 2-(METHYLTHIO)-5H-PYRROLO[3,4-D]PYRIMIDINE-6(7H)-CARBOXYLATE |
| 2-(methylsulfanyl)-5,7-dihydro-6H-pyrolo[3,4-d]pyrimidine-6-carboxylic acid tert-butyl ester |
| QC-5055 |
| tert-Butyl 2-(methylsulfanyl)-5,7-dihydro-6H-pyrrolo[3,4-d]pyrimidine-6-carboxylate |
| 2-Methyl-2-propanyl 2-(methylsulfanyl)-5,7-dihydro-6H-pyrrolo[3,4-d]pyrimidine-6-carboxylate |
| 6-(tert-Butoxycarbonyl)-5,7-dihydro-2-methylthiopyrrolo-[3,4-d]pyrimidine |
| 5,7-Dihydro-2-(methylthio)-6H-pyrrolo[3,4-d]pyrimidine-6-carboxylic acid 1,1-dimethylethyl ester |
| 6-Boc-2-(methylthio)-5,7-dihydropyrrolo[3,4-d]pyrimidine |