Introduction：Basic information about CAS 712-97-0|1,3-Benzodioxole-5-carboxaldehyde,6-nitro-, including its chemical name, molecular formula, synonyms, physicochemical properties, and safety information, etc.
| Common Name | 1,3-Benzodioxole-5-carboxaldehyde,6-nitro- |
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| CAS Number | 712-97-0 | Molecular Weight | 195.12900 |
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| Density | 1.572 g/cm3 | Boiling Point | 365.9ºC at 760 mmHg |
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| Molecular Formula | C8H5NO5 | Melting Point | 93-94 °C(lit.) |
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| MSDS | ChineseUSA | Flash Point | 195ºC |
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Names
| Name | 6-Nitropiperonal |
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| Synonym | More Synonyms |
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Chemical & Physical Properties
| Density | 1.572 g/cm3 |
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| Boiling Point | 365.9ºC at 760 mmHg |
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| Melting Point | 93-94 °C(lit.) |
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| Molecular Formula | C8H5NO5 |
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| Molecular Weight | 195.12900 |
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| Flash Point | 195ºC |
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| Exact Mass | 195.01700 |
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| PSA | 81.35000 |
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| LogP | 1.65920 |
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| Index of Refraction | 1.658 |
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| InChIKey | NRZWECORTTWSEF-UHFFFAOYSA-N |
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| SMILES | O=Cc1cc2c(cc1[N+](=O)[O-])OCO2 |
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Toxicological Information
CHEMICAL IDENTIFICATION - RTECS NUMBER :
- DF4912750
- CHEMICAL NAME :
- 1,3-Benzodioxole-5-carboxaldehyde, 6-nitro-
- CAS REGISTRY NUMBER :
- 712-97-0
- LAST UPDATED :
- 199410
- DATA ITEMS CITED :
- 2
- MOLECULAR FORMULA :
- C8-H5-N-O5
- MOLECULAR WEIGHT :
- 195.14
- WISWESSER LINE NOTATION :
- T56 BO DO CHJ GVH HNW
HEALTH HAZARD DATAACUTE TOXICITY DATA - TYPE OF TEST :
- LD50 - Lethal dose, 50 percent kill
- ROUTE OF EXPOSURE :
- Intravenous
- SPECIES OBSERVED :
- Rodent - mouse
- DOSE/DURATION :
- 56 mg/kg
- TOXIC EFFECTS :
- Details of toxic effects not reported other than lethal dose value
MUTATION DATA - TYPE OF TEST :
- Mutation in microorganisms
- TEST SYSTEM :
- Bacteria - Salmonella typhimurium
- DOSE/DURATION :
- 100 ug/plate
- REFERENCE :
- JAFCAU Journal of Agricultural and Food Chemistry. (American Chemical Soc., Distribution Office Dept. 223, POB 57136, West End Stn., Washington, DC 20037) V.1- 1953- Volume(issue)/page/year: 40,2211,1992
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Safety Information
| Personal Protective Equipment | Eyeshields;Gloves;type N95 (US);type P1 (EN143) respirator filter |
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| Hazard Codes | Xi |
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| Risk Phrases | R36/37/38 |
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| Safety Phrases | S37/39-S26 |
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| RIDADR | NONH for all modes of transport |
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| WGK Germany | 3 |
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| RTECS | DF4912750 |
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| HS Code | 2932999099 |
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Customs
| HS Code | 2932999099 |
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| Summary | 2932999099. other heterocyclic compounds with oxygen hetero-atom(s) only. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0% |
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Articles2
More Articles
| No-carrier-added regioselective preparation of 6-[18F]fluoro-L-dopa. J. Nucl. Med. 31(7) , 1247-51, (1990) This paper describes the preparation of 6-[18F]fluoro-L-dopa by a no-carrier-added method based on the nucleophilic displacement of nitro groups of two commercially available substrates, 3,4-dimethoxy... | |
| Can we predict reactivity for aromatic nucleophilic substitution with [18F] fluoride ion? Rengan R, et al. J. Labelled Comp. Radiopharm. 33(7) , 563-572, (1993)
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Synonyms
| MFCD00005829 |
| EINECS 211-926-1 |
| 6-nitro-1,3-benzodioxole-5-carbaldehyde |
