Introduction：Basic information about CAS 13231-00-0|1H-Purine-6,8-dione,7,9-dihydro-, including its chemical name, molecular formula, synonyms, physicochemical properties, and safety information, etc.
| Common Name | 1H-Purine-6,8-dione,7,9-dihydro- |
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| CAS Number | 13231-00-0 | Molecular Weight | 152.11100 |
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| Density | 2.19g/cm3 | Boiling Point | 587.1ºC at 760mmHg |
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| Molecular Formula | C5H4N4O2 | Melting Point | / |
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| MSDS | / | Flash Point | 308.9ºC |
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Names
| Name | 7,9-dihydro-3H-purine-6,8-dione |
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| Synonym | More Synonyms |
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Chemical & Physical Properties
| Density | 2.19g/cm3 |
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| Boiling Point | 587.1ºC at 760mmHg |
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| Molecular Formula | C5H4N4O2 |
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| Molecular Weight | 152.11100 |
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| Flash Point | 308.9ºC |
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| Exact Mass | 152.03300 |
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| PSA | 94.92000 |
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| Vapour Pressure | 2.21E-14mmHg at 25°C |
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| Index of Refraction | 1.989 |
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| InChIKey | BYUOBSUZYQAFJM-UHFFFAOYSA-N |
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| SMILES | O=c1[nH]c2nc[nH]c(=O)c2[nH]1 |
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Toxicological Information
CHEMICAL IDENTIFICATION - RTECS NUMBER :
- UO8251450
- CHEMICAL NAME :
- 1H-Purine-6,8-dione, 7,9-dihydro-
- CAS REGISTRY NUMBER :
- 13231-00-0
- LAST UPDATED :
- 199712
- DATA ITEMS CITED :
- 2
- MOLECULAR FORMULA :
- C5-H4-N4-O2
- MOLECULAR WEIGHT :
- 152.13
HEALTH HAZARD DATAACUTE TOXICITY DATA - TYPE OF TEST :
- LD50 - Lethal dose, 50 percent kill
- ROUTE OF EXPOSURE :
- Oral
- SPECIES OBSERVED :
- Rodent - rat
- DOSE/DURATION :
- 1759 mg/kg
- TOXIC EFFECTS :
- Details of toxic effects not reported other than lethal dose value
- REFERENCE :
- JKXXAF Japanese Kokai Tokyo Koho Patents. (U.S. Patent and Trademark Office, Foreign Patents, Washington, DC 20231) Volume(issue)/page/year: #78-55733
- TYPE OF TEST :
- LD50 - Lethal dose, 50 percent kill
- ROUTE OF EXPOSURE :
- Intraperitoneal
- SPECIES OBSERVED :
- Rodent - rat
- DOSE/DURATION :
- 545 mg/kg
- TOXIC EFFECTS :
- Details of toxic effects not reported other than lethal dose value
- REFERENCE :
- JKXXAF Japanese Kokai Tokyo Koho Patents. (U.S. Patent and Trademark Office, Foreign Patents, Washington, DC 20231) Volume(issue)/page/year: #78-55733
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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
| 8-Oxohypoxanthine |
| 6,8-dioxopurine |
| Purine-6,8-diol |
| 6,8-Dihydroxypurine |
| Purine-6,8(1H,9H)-dione |
| 6,8-Dihydroxy-purin |
| Purine-6,8-dione |
| 2,4-dioxypurine |
| 7,9-Dihydro-1H-purin-6,8-dion |
| 7H-Purine-6,8-diol |
| diceto-6,8 purine |
| 1H-Purine-6,8-dione,7,9-dihydro |
| EINECS 236-203-8 |
| 7,9-Dihydro-1H-purine-6,8-dione |
