Introduction：Basic information about CAS 4504-88-5|UNII:7O29I2R0ZG, including its chemical name, molecular formula, synonyms, physicochemical properties, and safety information, etc.
| Common Name | UNII:7O29I2R0ZG |
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| CAS Number | 4504-88-5 | Molecular Weight | 297.391 |
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| Density | 1.1±0.1 g/cm3 | Boiling Point | 439.2±45.0 °C at 760 mmHg |
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| Molecular Formula | C19H23NO2 | Melting Point | / |
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| MSDS | / | Flash Point | 219.4±28.7 °C |
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Names
| Name | 11-[3-(dimethylamino)propyl]-6H-benzo[c][1]benzoxepin-11-ol |
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| Synonym | More Synonyms |
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Chemical & Physical Properties
| Density | 1.1±0.1 g/cm3 |
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| Boiling Point | 439.2±45.0 °C at 760 mmHg |
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| Molecular Formula | C19H23NO2 |
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| Molecular Weight | 297.391 |
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| Flash Point | 219.4±28.7 °C |
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| Exact Mass | 297.172882 |
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| PSA | 32.70000 |
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| LogP | 1.76 |
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| Vapour Pressure | 0.0±1.1 mmHg at 25°C |
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| Index of Refraction | 1.583 |
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| InChIKey | ZEKLFUWSVQYTOO-UHFFFAOYSA-N |
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| SMILES | CN(C)CCCC1(O)c2ccccc2COc2ccccc21 |
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Toxicological Information
CHEMICAL IDENTIFICATION - RTECS NUMBER :
- HQ4240000
- CHEMICAL NAME :
- Dibenz(b,e)oxepin-11-ol, 6,11-dihydro-11-(3-dimethylaminopropyl)-
- CAS REGISTRY NUMBER :
- 4504-88-5
- LAST UPDATED :
- 199612
- DATA ITEMS CITED :
- 1
- MOLECULAR FORMULA :
- C19-H23-N-O2
- MOLECULAR WEIGHT :
- 297.43
- WISWESSER LINE NOTATION :
- T C676 IO&T&J B3N1&1
HEALTH HAZARD DATAACUTE TOXICITY DATA - TYPE OF TEST :
- LDLo - Lowest published lethal dose
- ROUTE OF EXPOSURE :
- Intraperitoneal
- SPECIES OBSERVED :
- Rodent - mouse
- DOSE/DURATION :
- 300 mg/kg
- TOXIC EFFECTS :
- Details of toxic effects not reported other than lethal dose value
- REFERENCE :
- JMPCAS Journal of Medicinal and Pharmaceutical Chemistry. (Washington, DC) V.1-5, 1959-62. For publisher information, see JMCMAR. Volume(issue)/page/year: 5,1207,1962
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Safety Information
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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Synonyms
| einecs 224-821-0 |
| Dibenz[b,e]oxepin-11-ol, 11-[3-(dimethylamino)propyl]-6,11-dihydro- |
| UNII:7O29I2R0ZG |
| 11-[3-(Dimethylamino)propyl]-6,11-dihydrodibenzo[b,e]oxepin-11-ol |
