Introduction：Basic information about CAS 502133-49-5|4-(3-carboxy-pyridin-2-yl)-[1,4]diazepane-1-carboxylic acid tert-butyl ester, including its chemical name, molecular formula, synonyms, physicochemical properties, and safety information, etc.
| Common Name | 4-(3-carboxy-pyridin-2-yl)-[1,4]diazepane-1-carboxylic acid tert-butyl ester |
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| CAS Number | 502133-49-5 | Molecular Weight | 321.37200 |
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| Density | 1.219g/cm3 | Boiling Point | 490.5ºC at 760 mmHg |
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| Molecular Formula | C16H23N3O4 | Melting Point | / |
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| MSDS | USA | Flash Point | 250.4ºC |
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Names
| Name | 4-(3-carboxy-pyridin-2-yl)-[1,4]diazepane-1-carboxylic acid tert-butyl ester |
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Chemical & Physical Properties
| Density | 1.219g/cm3 |
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| Boiling Point | 490.5ºC at 760 mmHg |
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| Molecular Formula | C16H23N3O4 |
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| Molecular Weight | 321.37200 |
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| Flash Point | 250.4ºC |
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| Exact Mass | 321.16900 |
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| PSA | 82.97000 |
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| LogP | 2.22990 |
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| Index of Refraction | 1.554 |
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| InChIKey | VNNVAWDHPDFXLR-UHFFFAOYSA-N |
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| SMILES | CC(C)(C)OC(=O)N1CCCN(c2ncccc2C(=O)O)CC1 |
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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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