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| CAS No.: | 35108-88-4 |
|---|---|
| Name: | tert-butyl[2-hydroxy-3-[2-[(tetrahydro-2-furyl)methoxy]phenoxy]propyl]ammonium chloride |
| Molecular Structure: | |
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| Formula: | C18H29 N O4 . Cl H |
| Molecular Weight: | 359.94 |
| Synonyms: | 2-Propanol,1-[(1,1-dimethylethyl)amino]-3-[2-[(tetrahydro-2-furanyl)methoxy]phenoxy]-,hydrochloride (9CI);1-tert-Butylamino-3-[o-(tetrahydrofurfuryloxy)phenoxy]-2-propanolhydrochloride; Adobiol; Bufetolol-hydrochloride;DL-1-tert-Butylamino-3-[o-(tetrahydrofurfuryloxy)phenoxy]-2-propanol hydrochloride;Y 6124 |
| Density: | g/cm3 |
| Melting Point: | 153.5-157°; mp 151-154°; (Diastereoisomer, mp 118°) |
| Boiling Point: | 476.4°Cat760mmHg |
| Flash Point: | 241.9°C |
| Safety: | Poison by intravenous route. Moderately toxic by ingestion and subcutaneous routes. An experimental teratogen. Other experimental reproductive effects. When heated to decomposition it emits very toxic fumes of HCl and NOx. An antiarrhythmic drug. |
| PSA: | 59.95000 |
| LogP: | 3.56510 |
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Chemistry
Molecular Structure of Adobiol (CAS NO.35108-88-4):
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IUPAC Name: 1-(tert-butylamino)-3-[2-(oxolan-2-ylmethoxy)phenoxy]propan-2-ol hydrochloride
Empirical Formula: C18H30ClNO4
Molecular Weight: 359.8881
Flash Point: 241.9 °C
Enthalpy of Vaporization: 77.96 kJ/mol
Boiling Point: 476.4 °C at 760 mmHg
Vapour Pressure: 7E-10 mmHg at 25°C
Synonyms of Adobiol (CAS NO.35108-88-4): tert-butyl[2-hydroxy-3-[2-[(tetrahydro-2-furyl)methoxy]phenoxy]propyl]ammonium chloride ; 1-tert-Butylamino-3-[o-(tetrahydrofurfuryloxy)phenoxy]-2-propanol hydrochloride ; 2-Propanol, 1-[(1,1-dimethylethyl)amino]-3-[2-[(tetrahydro-2-furanyl)methoxy]phenoxy]-, hydrochloride;Adobiol ; bufetolol hydrochloride ; Bufetolol-hydrochloride ; DL-1-tert-Butylamino-3-[o-(tetrahydrofurfuryloxy)phenoxy]-2-propanol hydrochloride
Toxicity Data With Reference
| 1. | orl-rat LD50:1088 mg/kg | DRUGAY Drugs. International Journal of Current Therapeutics and Applied Pharmacology Reviews. 6 (1982),681. | ||
| 2. | scu-rat LD50:1814 mg/kg | DRUGAY Drugs. International Journal of Current Therapeutics and Applied Pharmacology Reviews. 6 (1982),681. | ||
| 3. | ivn-rat LD50:59,400 µg/kg | DRUGAY Drugs. International Journal of Current Therapeutics and Applied Pharmacology Reviews. 6 (1982),681. | ||
| 4. | orl-mus LD50:402 mg/kg | DRUGAY Drugs. International Journal of Current Therapeutics and Applied Pharmacology Reviews. 6 (1982),681. | ||
| 5. | scu-mus LD50:501 mg/kg | DRUGAY Drugs. International Journal of Current Therapeutics and Applied Pharmacology Reviews. 6 (1982),681. |
Safety Profile
Poison by intravenous route. Moderately toxic by ingestion and subcutaneous routes. An experimental teratogen. Other experimental reproductive effects. When heated to decomposition it emits very toxic fumes of HCl and NOx. An antiarrhythmic drug.
Specification
Adobiol (CAS NO.35108-88-4) is a poisoning product, with flammable, while burning releases toxic fumes of nitrogen oxides and hydrogen chloride, and should be stored in ventilated ,low-temperature, drying environment,besides should be kept separate with food and raw materials , dry powder, foam, sand, carbon dioxide, water mist fire-extinguishing agent can be used if emergency.