Introduction:Basic information about CAS 65685-50-9|5-Bromobenzo[d]isoxazol-3(2H)-one, including its chemical name, molecular formula, synonyms, physicochemical properties, and safety information, etc.
| Common Name | 5-Bromobenzo[d]isoxazol-3(2H)-one |
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| CAS Number | 65685-50-9 | Molecular Weight | 214.016 |
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| Density | 1.9±0.1 g/cm3 | Boiling Point | 360.6±22.0 °C at 760 mmHg |
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| Molecular Formula | C7H4BrNO2 | Melting Point | / |
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| MSDS | / | Flash Point | 171.9±22.3 °C |
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Names
| Name | 5-Bromobenzo[d]isoxazol-3(2H)-one |
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| Synonym | More Synonyms |
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Chemical & Physical Properties
| Density | 1.9±0.1 g/cm3 |
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| Boiling Point | 360.6±22.0 °C at 760 mmHg |
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| Molecular Formula | C7H4BrNO2 |
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| Molecular Weight | 214.016 |
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| Flash Point | 171.9±22.3 °C |
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| Exact Mass | 212.942535 |
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| PSA | 46.26000 |
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| LogP | 1.66 |
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| Vapour Pressure | 0.0±0.8 mmHg at 25°C |
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| Index of Refraction | 1.698 |
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| InChIKey | XLPXBJYNYXPQAO-UHFFFAOYSA-N |
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| SMILES | O=c1[nH]oc2ccc(Br)cc12 |
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| Storage condition | 2-8°C |
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Toxicological Information
CHEMICAL IDENTIFICATION - RTECS NUMBER :
- DE4933600
- CHEMICAL NAME :
- 1,2-Benzisoxazol-3(2H)-one, 5-bromo-
- CAS REGISTRY NUMBER :
- 65685-50-9
- LAST UPDATED :
- 199612
- DATA ITEMS CITED :
- 1
- MOLECULAR FORMULA :
- C7-H4-Br-N-O2
- MOLECULAR WEIGHT :
- 214.03
HEALTH HAZARD DATAACUTE TOXICITY DATA - TYPE OF TEST :
- LD50 - Lethal dose, 50 percent kill
- ROUTE OF EXPOSURE :
- Intraperitoneal
- SPECIES OBSERVED :
- Rodent - mouse
- DOSE/DURATION :
- 450 mg/kg
- TOXIC EFFECTS :
- Behavioral - altered sleep time (including change in righting reflex) Lungs, Thorax, or Respiration - dyspnea
- REFERENCE :
- APPHAX Acta Poloniae Pharmaceutica. For English translation, see APPFAR. (Ars Polona, POB 1001, 00-680 Warsaw 1, Poland) V.1- 1937- Volume(issue)/page/year: 36,241,1979
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Safety Information
| Hazard Codes | Xi |
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| HS Code | 2934999090 |
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Customs
| HS Code | 2934999090 |
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| Summary | 2934999090. other heterocyclic compounds. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0% |
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Synonyms
| 5-bromo-1,2-benzoxazol-3-one |
| 1,2-Benzisoxazol-3(2H)-one, 5-bromo- |
| 5-Bromo-1,2-benzoxazol-3(2H)-one |