Australine
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Australine
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CAS No:
118396-02-4
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Formula:
C8H15NO4
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Chemical Name:
Australine
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Synonyms:
1H-Pyrrolizine-1,2,7-triol,hexahydro-3-(hydroxymethyl)-,(1R,2R,3R,7S,7aR)-;1H-Pyrrolizine-1,2,7-triol,hexahydro-3-(hydroxymethyl)-,[1R-(1α,2β,3α,7β,7aα)]-;(1R,2R,3R,7S,7aR)-Hexahydro-3-(hydroxymethyl)-1H-pyrrolizine-1,2,7-triol;Australine;7a-epi-Alexine;7a-Epialexine;(+)-Australine
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CAS No:
Characteristics
84.16000
1.53g/cm3
148-149 °C @ Solvent: Acetone
417.4ºC at 760mmHg
263.5ºC
1.647
0-6°C
Computed Properties
Molecular Weight:189.21
XLogP3:-1.7
Hydrogen Bond Donor Count:4
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:1
Exact Mass:189.10010796
Monoisotopic Mass:189.10010796
Topological Polar Surface Area:84.2
Heavy Atom Count:13
Complexity:201
Defined Atom Stereocenter Count:5
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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