Introduction：Basic information about CAS 83-29-4|2,4,6(1H,3H,5H)-Pyrimidinetrione,5-(1-methylbutyl)-, including its chemical name, molecular formula, synonyms, physicochemical properties, and safety information, etc.
| Common Name | 2,4,6(1H,3H,5H)-Pyrimidinetrione,5-(1-methylbutyl)- |
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| CAS Number | 83-29-4 | Molecular Weight | 198.21900 |
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| Density | 1.144g/cm3 | Boiling Point | / |
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| Molecular Formula | C9H14N2O3 | Melting Point | / |
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| MSDS | / | Flash Point | / |
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Names
| Name | 5-pentan-2-yl-1,3-diazinane-2,4,6-trione |
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| Synonym | More Synonyms |
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Chemical & Physical Properties
| Density | 1.144g/cm3 |
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| Molecular Formula | C9H14N2O3 |
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| Molecular Weight | 198.21900 |
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| Exact Mass | 198.10000 |
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| PSA | 75.27000 |
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| LogP | 1.06240 |
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| Index of Refraction | 1.474 |
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| InChIKey | QSELDKYOARDOCZ-UHFFFAOYSA-N |
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| SMILES | CCCC(C)C1C(=O)NC(=O)NC1=O |
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Toxicological Information
CHEMICAL IDENTIFICATION - RTECS NUMBER :
- CQ7171700
- CHEMICAL NAME :
- Barbituric acid, 5-(1-methylbutyl)-
- CAS REGISTRY NUMBER :
- 83-29-4
- BEILSTEIN REFERENCE NO. :
- 0187936
- LAST UPDATED :
- 199612
- DATA ITEMS CITED :
- 1
- MOLECULAR FORMULA :
- C9-H14-N2-O3
- MOLECULAR WEIGHT :
- 198.25
- WISWESSER LINE NOTATION :
- T6VMVMV FHJ FY3&1
HEALTH HAZARD DATAACUTE TOXICITY DATA - TYPE OF TEST :
- LD50 - Lethal dose, 50 percent kill
- ROUTE OF EXPOSURE :
- Intravenous
- SPECIES OBSERVED :
- Rodent - mouse
- DOSE/DURATION :
- 180 mg/kg
- TOXIC EFFECTS :
- Details of toxic effects not reported other than lethal dose value
- REFERENCE :
- CSLNX* U.S. Army Armament Research & Development Command, Chemical Systems Laboratory, NIOSH Exchange Chemicals. (Aberdeen Proving Ground, MD 21010) Volume(issue)/page/year: NX#04623
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Synonyms
