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benzyl [(2S)-4-amino-1-({(2S,3R)-4-[(3S,4aS,8aS)-3-(tert-butylcarbamoyl)octahydroisoquinolin-2(1H)-yl]-3-hydroxy-1-phenylbutan-2-yl}amino)-1,4-dioxobutan-2-yl]carbamate (non-preferred name) (136522-18-4)

Identification
Name:benzyl [(2S)-4-amino-1-({(2S,3R)-4-[(3S,4aS,8aS)-3-(tert-butylcarbamoyl)octahydroisoquinolin-2(1H)-yl]-3-hydroxy-1-phenylbutan-2-yl}amino)-1,4-dioxobutan-2-yl]carbamate (non-preferred name)
Synonyms:carbamic acid, N-[(1S)-3-amino-1-[[[(1S,2R)-3-[(3S,4aS,8aS)-3-[[(1,1-dimethylethyl)amino]carbonyl]octahydro-2(1H)-isoquinolinyl]-2-hydroxy-1-(phenylmethyl)propyl]amino]carbonyl]-3-oxopropyl]-, phenylmethyl ester
CAS:136522-18-4
Molecular Formula: C36H51N5O6
Molecular Weight: 649.82
InChI: InChI=1/C36H51N5O6/c1-36(2,3)40-34(45)30-19-26-16-10-11-17-27(26)21-41(30)22-31(42)28(18-24-12-6-4-7-13-24)38-33(44)29(20-32(37)43)39-35(46)47-23-25-14-8-5-9-15-25/h4-9,12-15,26-31,42H,10-11,16-23H2,1-3H3,(H2,37,43)(H,38,44)(H,39,46)(H,40,45)/t26-,27+,28-,29-,30-,31+/m0/s1
Molecular Structure: (C36H51N5O6) carbamic acid, N-[(1S)-3-amino-1-[[[(1S,2R)-3-[(3S,4aS,8aS)-3-[[(1,1-dimethylethyl)amino]carbonyl]oc...
Properties
Flash Point: 519.6°C
Boiling Point: 935.5°C at 760 mmHg
Density:1.186g/cm3
Refractive index:1.567
Flash Point: 519.6°C
Safety Data
 

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