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Structure

N-Deformyl-N-benzyloxycarbonyl orlistat

CAS
108051-94-1
Catalog Number
ACM108051941
Category
Other Products
Molecular Weight
601.86
Molecular Formula
C36H59NO6

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Specification

Synonyms
N-[(Phenylmethoxy)carbonyl]-L-Leucine (1S)-1-[[(2S,3S)-3-Hexyl-4
-oxo-2-oxetanyl]methyl]dodecyl Ester;
IUPAC Name
[(2S)-1-[(2S,3S)-3-hexyl-4-oxooxetan-2-yl]tridecan-2-yl] (2S)-4-methyl-2-(phenylmethoxycarbonylamino)pentanoate
Canonical SMILES
CCCCCCCCCCCC(CC1C(C(=O)O1)CCCCCC)OC(=O)C(CC(C)C)NC(=O)OCC2=CC=CC=C2
InChI Key
OITCZADOYPEICM-YRCZKMHPSA-N
Boiling Point
685.897ºC at 760 mmHg
Flash Point
368.617ºC
Density
1.018g/cm³
Exact Mass
601.43400
H-Bond Acceptor
6
H-Bond Donor
1
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