Introduction：Basic information about CAS 130-90-5|quinine formate, including its chemical name, molecular formula, synonyms, physicochemical properties, and safety information, etc.
| Common Name | quinine formate |
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| CAS Number | 130-90-5 | Molecular Weight | 370.44200 |
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| Density | 1.21g/cm3 | Boiling Point | 495.9ºC at 760mmHg |
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| Molecular Formula | C21H26N2O4 | Melting Point | / |
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| MSDS | / | Flash Point | 253.7ºC |
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Names
| Name | (R)-[(2S,4S,5R)-5-ethenyl-1-azabicyclo[2.2.2]octan-2-yl]-(6-methoxyquinolin-4-yl)methanol,formic acid |
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| Synonym | More Synonyms |
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Chemical & Physical Properties
| Density | 1.21g/cm3 |
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| Boiling Point | 495.9ºC at 760mmHg |
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| Molecular Formula | C21H26N2O4 |
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| Molecular Weight | 370.44200 |
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| Flash Point | 253.7ºC |
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| Exact Mass | 370.18900 |
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| PSA | 82.89000 |
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| LogP | 3.44780 |
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| Vapour Pressure | 1.19E-10mmHg at 25°C |
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| InChIKey | LKUVXQMSYPYURB-DSXUQNDKSA-N |
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| SMILES | C=CC1CN2CCC1CC2C(O)c1ccnc2ccc(OC)cc12.O=CO |
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Toxicological Information
CHEMICAL IDENTIFICATION - RTECS NUMBER :
- VA6740000
- CHEMICAL NAME :
- Quinine, formate (salt)
- CAS REGISTRY NUMBER :
- 130-90-5
- LAST UPDATED :
- 199106
- DATA ITEMS CITED :
- 2
- MOLECULAR FORMULA :
- C20-H24-N2-O2.C-H2-O2
- MOLECULAR WEIGHT :
- 370.49
- WISWESSER LINE NOTATION :
- T66 BNJ HO1 EYOVH- DT66 A B CNTJ A1U1
HEALTH HAZARD DATAACUTE TOXICITY DATA - TYPE OF TEST :
- LD50 - Lethal dose, 50 percent kill
- ROUTE OF EXPOSURE :
- Intramuscular
- SPECIES OBSERVED :
- Mammal - dog
- DOSE/DURATION :
- 290 mg/kg
- TOXIC EFFECTS :
- Details of toxic effects not reported other than lethal dose value
- REFERENCE :
- THERAP Therapie. (Doin, Editeurs, 8, Place de l'Odeon, F-75006 Paris, France) V.1- 1946- Volume(issue)/page/year: 26,563,1971 ** REPRODUCTIVE DATA **
- TYPE OF TEST :
- TDLo - Lowest published toxic dose
- ROUTE OF EXPOSURE :
- Intramuscular
- DOSE :
- 450 mg/kg
- SEX/DURATION :
- female 18-47 day(s) after conception
- TOXIC EFFECTS :
- Reproductive - Fertility - post-implantation mortality (e.g. dead and/or resorbed implants per total number of implants)
- REFERENCE :
- THERAP Therapie. (Doin, Editeurs, 8, Place de l'Odeon, F-75006 Paris, France) V.1- 1946- Volume(issue)/page/year: 26,563,1971
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Safety Information
| Hazard Codes | Xi |
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| Risk Phrases | 36/37/38 |
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| Safety Phrases | S26;S36 |
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| RIDADR | UN 1544 |
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| Packaging Group | III |
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| Hazard Class | 6.1(b) |
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Synonyms
| Chinin,Formiat |
| Quinine formate |
| EINECS 205-002-7 |
