1,3-Propanediol, 2-amino-2-[2-(4-octylphenyl)ethyl]-, 1-(dihydrogen phosphate), (2S)-
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1,3-Propanediol, 2-amino-2-[2-(4-octylphenyl)ethyl]-, 1-(dihydrogen phosphate), (2S)-
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CAS No:
402616-26-6
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Formula:
C19H34NO5P
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Chemical Name:
1,3-Propanediol, 2-amino-2-[2-(4-octylphenyl)ethyl]-, 1-(dihydrogen phosphate), (2S)-
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Synonyms:
1,3-Propanediol,2-amino-2-[2-(4-octylphenyl)ethyl]-,1-(dihydrogen phosphate),(2S)-;1,3-Propanediol,2-amino-2-[2-(4-octylphenyl)ethyl]-,mono(dihydrogen phosphate) (ester),(2S)-;(+)-(S)-FTY 720 phosphate;(S)-FTY 720P;(S)-2-Amino-2-(hydroxymethyl)-4-(4-octylphenyl)butyl dihydrogen phosphate
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CAS No:
1,3-Propanediol, 2-amino-2-[2-(4-octylphenyl)ethyl]-, 1-(dihydrogen phosphate), (2S)- Basic Attributes
387.45100
387.45
92YDM6122J
Characteristics
122.82000
4.02160
1.173g/cm3
198-199 °C @ Solvent: Ethanol, Water
584.237ºC
307.136ºC
1.541
Computed Properties
Molecular Weight:387.5
XLogP3:0.8
Hydrogen Bond Donor Count:4
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:14
Exact Mass:387.21746018
Monoisotopic Mass:387.21746018
Topological Polar Surface Area:113
Heavy Atom Count:26
Complexity:409
Defined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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