Introduction：Basic information about CAS 16659-88-4|6,7-Isoquinolinediol,1-[(3,4-dihydroxyphenyl)methyl]-1,2,3,4-tetrahydro-, hydrobromid, including its chemical name, molecular formula, synonyms, physicochemical properties, and safety information, etc.
| Common Name | 6,7-Isoquinolinediol,1-[(3,4-dihydroxyphenyl)methyl]-1,2,3,4-tetrahydro-, hydrobromide (1:1) |
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| CAS Number | 16659-88-4 | Molecular Weight | 368.22200 |
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| Density | 1.406g/cm3 | Boiling Point | 573.2ºC at 760mmHg |
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| Molecular Formula | C16H18BrNO4 | Melting Point | 277ºC (dec.)(lit.) |
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| MSDS | / | Flash Point | 235.1ºC |
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Names
| Name | (+/-)-tetrahydropapaveroline hydrobromide |
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| Synonym | More Synonyms |
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Chemical & Physical Properties
| Density | 1.406g/cm3 |
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| Boiling Point | 573.2ºC at 760mmHg |
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| Melting Point | 277ºC (dec.)(lit.) |
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| Molecular Formula | C16H18BrNO4 |
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| Molecular Weight | 368.22200 |
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| Flash Point | 235.1ºC |
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| Exact Mass | 367.04200 |
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| PSA | 92.95000 |
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| LogP | 3.22540 |
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| Vapour Pressure | 9.67E-14mmHg at 25°C |
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| InChIKey | WAADYLVPNMRUKN-UHFFFAOYSA-N |
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| SMILES | Br.Oc1ccc(CC2NCCc3cc(O)c(O)cc32)cc1O |
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Toxicological Information
CHEMICAL IDENTIFICATION - RTECS NUMBER :
- NX0480000
- CHEMICAL NAME :
- 6,7-Isoquinolinediol, 1,2,3,4-tetrahydro-1-(3,4-dihydroxybenzyl)-, hydrobromide
- CAS REGISTRY NUMBER :
- 16659-88-4
- LAST UPDATED :
- 198308
- DATA ITEMS CITED :
- 1
- MOLECULAR FORMULA :
- C16-H17-N-O4.Br-H
- MOLECULAR WEIGHT :
- 368.26
- WISWESSER LINE NOTATION :
- T66 CMT&J B1R CQ DQ& HQ IQ &EH
HEALTH HAZARD DATAACUTE TOXICITY DATA - TYPE OF TEST :
- LD50 - Lethal dose, 50 percent kill
- ROUTE OF EXPOSURE :
- Intraperitoneal
- SPECIES OBSERVED :
- Rodent - mouse
- DOSE/DURATION :
- 850 mg/kg
- TOXIC EFFECTS :
- Behavioral - muscle contraction or spasticity Lungs, Thorax, or Respiration - dyspnea
- REFERENCE :
- THERAP Therapie. (Doin, Editeurs, 8, Place de l'Odeon, F-75006 Paris, France) V.1- 1946- Volume(issue)/page/year: 26,1175,1971
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Safety Information
| Hazard Codes | Xn: Harmful; |
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| Risk Phrases | 22 |
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| Safety Phrases | S24/25 |
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| HS Code | 2933499090 |
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Customs
| HS Code | 2933499090 |
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| Summary | 2933499090. other compounds containing in the structure a quinoline or isoquinoline ring-system (whether or not hydrogenated), not further fused. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0% |
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Synonyms
| NORLAUDANOSOLINE HYDROBROMIDE |
| (+/-)-Tetrahydropapaveroline-Hydrogen Bromide |
| 7-isoquinolinediol,1,2,3,4-tetrahydro-1-(3,4-dihydroxybenzyl)-hydrobromide |
| (+-)-Tetrahydropapaveroline hydrobromide |
| (+/-)-6,7-dihydroxy-(3',4'-dihydroxybenzyl)-1,2,3,4-tetrahydroisoquinoline hydrobromide |
| EINECS 221-680-7 |
| 7-isoquinolinediol,1-((3,4-dihydroxyphenyl)methyl)-1,2,3,4-tetrahydro-hb |
| bromhydratedetetrahydropapaveroline |
| MFCD00012742 |
| tetrahydropapaverolinebromide |
| 1,2,3,4-tetrahydro-1-(3,4-dihydroxybenzyl)-6,7-isoquinolinediolhydrobromide |
