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22235-85-4

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Basic Information
CAS No.: 22235-85-4
Name: 8-prop-2-en-1-yl-8-azabicyclo[3.2.1]oct-3-yl 3-hydroxy-2-phenylpropanoate
Molecular Structure:
Molecular Structure of 22235-85-4 (8-prop-2-en-1-yl-8-azabicyclo[3.2.1]oct-3-yl 3-hydroxy-2-phenylpropanoate)
Formula: C19H25 N O3
Molecular Weight: 315.412
Synonyms: 1aH,5aH-Nortropan-3a-ol, 8-allyl-, (?à)-tropate (ester) (8CI); Benzeneacetic acid, a-(hydroxymethyl)-,8-(2-propenyl)-8-azabicyclo[3.2.1]oct-3-yl ester, endo- (9CI); Benzeneaceticacid, a-(hydroxymethyl)-,8-(2-propenyl)-8-azabicyclo[3.2.1]oct-3-yl ester, endo-(?à)-; 8-Allylnortropine tropate;8-allyl-3a-Nortropanyl tropate; N 728;Naltropine
Density: 1.16g/cm3
Melting Point: 77 °C
Boiling Point: 452.1°C at 760 mmHg
Flash Point: 227.2°C
Safety: Poison by intravenous and intraperitoneal routes. When heated to decomposition it emits toxic fumes of NOx. See also ALLYL COMPOUNDS.
PSA: 49.77000
LogP: 2.42500
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Chemistry

Molecular Structure of 8-Allyl-(±)-1-α-h,5-α-h-northropan-3-α-ol (CAS NO.22235-85-4):

IUPAC Name: (8-prop-2-enyl-8-azabicyclo[3.2.1]octan-3-yl) 3-hydroxy-2-phenylpropanoate
Empirical Formula: C19H25NO
Molecular Weight: 315.4067 
Surface Tension: 49.1 dyne/cm 
Density: 1.16 g/cm
Flash Point: 227.2 °C 
Enthalpy of Vaporization: 74.95 kJ/mol 
Boiling Point: 452.1 °C at 760 mmHg 
Vapour Pressure: 5.82E-09 mmHg at 25°C 
Index of Refraction: 1.579

Toxicity Data With Reference

1.    

ivn-rat LD50:60 mg/kg

    ARZNAD    Arzneimittel-Forschung. Drug Research. 13 (1963),567.
2.    

ipr-mus LD50:165 mg/kg

    AIPTAK    Archives Internationales de Pharmacodynamie et de Therapie. 154 (1965),210.

Safety Profile

Poison by intravenous and intraperitoneal routes. When heated to decomposition it emits toxic fumes of NOx. See also ALLYL COMPOUNDS.

Specification

 8-Allyl-(±)-1-α-h,5-α-h-northropan-3-α-ol , with CAS number of 22235-85-4, can be called Noratropine, N-allyl- ; Naltropine; N-Allylnoratropine; 8-Allylnortropine tropate; 8-(2-Propenyl)-8-azabicyclo(3.2.1)oct-3-yl alpha-(hydroxymethyl)benzeneacetate endo- and so on.