Ethanol, 2-[[(3aR,4S,6R,6aS)-6-[[5-aMino-6-chloro-2-(propylthio)-4-pyriMidinyl]aMino]tetrahydro-2,2-diMethyl-4H-cyclopenta-1,3-dioxol-4-yl]oxy]-

Ethanol, 2-[[(3aR,4S,6R,6aS)-6-[[5-aMino-6-chloro-2-(propylthio)-4-pyriMidinyl]aMino]tetrahydro-2,2-diMethyl-4H-cyclopenta-1,3-dioxol-4-yl]oxy]- Structure
CAS No.
376608-74-1
Chemical Name:
Ethanol, 2-[[(3aR,4S,6R,6aS)-6-[[5-aMino-6-chloro-2-(propylthio)-4-pyriMidinyl]aMino]tetrahydro-2,2-diMethyl-4H-cyclopenta-1,3-dioxol-4-yl]oxy]-
Synonyms
Ticagrelor-16;Ticagrelor Impurity 48;Ticagrelor Impurity 111;Ticagrelor intermediate 12;Ethanol, 2-[[(3aR,4S,6R,6aS)-6-[[5-amino-6-chloro-2-(propylt...;2-[[(3aR,4S,6R,6aS)-6-[[5-Amino-6-chloro-2-(propylthio)-4-pyrimidinyl]amino]tetrahydro-2,2-dimethyl-;ETHANOL, 2-[[(3AR,4S,6R,6AS)-6-[[5- AMINO-6-CHLORO-2-(PROPYLTHIO) -4-PYRIMIDINYL]AMINO]TETRAHYDRO-2,2-DIMETHYL-4H-CYCLOPENTA-1,3-DIOX;(3aR,4S,6R,6aS)-2-[6-(5-Amino-6-chloro-2-propylsulfanyl-pyrimidin-4-ylamino)-2,2-dimethyl-tetrahydro-cyclopenta[1,3]dioxol-4-yloxy]-ethanol;2-[[(3aR,4S,6R,6aS)-6-[[5-Amino-6-chloro-2-(propylthio)-4-pyrimidinyl]amino]tetrahydro-2,2-dimethyl-4H-cyclopenta-1,3-dioxol-4-yl]oxy]-ethanol;Ethanol, 2-[[(3aR,4S,6R,6aS)-6-[[5-aMino-6-chloro-2-(propylthio)-4-pyriMidinyl]aMino]tetrahydro-2,2-diMethyl-4H-cyclopenta-1,3-dioxol-4-yl]oxy]-
CBNumber:
CB42563406
Molecular Formula:
C17H27ClN4O4S
Molecular Weight:
418.94
MOL File:
376608-74-1.mol
MSDS File:
SDS
Modify Date:
2023/4/23 13:52:06

Ethanol, 2-[[(3aR,4S,6R,6aS)-6-[[5-aMino-6-chloro-2-(propylthio)-4-pyriMidinyl]aMino]tetrahydro-2,2-diMethyl-4H-cyclopenta-1,3-dioxol-4-yl]oxy]- Properties

Melting point 85-88°C
Boiling point 598.9±50.0 °C(Predicted)
Density 1.37±0.1 g/cm3 (20 ºC 760 Torr)
storage temp. Keep in dark place,Inert atmosphere,Store in freezer, under -20°C
solubility Chloroform (Slightly), DMSO (Slightly), Methanol (Slightly)
form Solid
pka 14.33±0.10(Predicted)
color Off-White to Light Beige
Water Solubility 35mg/L at 22℃
Stability Hygroscopic

SAFETY

Risk and Safety Statements

Symbol(GHS) 
GHS07
Signal word  Warning
Hazard statements  H302-H315-H319-H335
Precautionary statements  P261-P305+P351+P338

Ethanol, 2-[[(3aR,4S,6R,6aS)-6-[[5-aMino-6-chloro-2-(propylthio)-4-pyriMidinyl]aMino]tetrahydro-2,2-diMethyl-4H-cyclopenta-1,3-dioxol-4-yl]oxy]- Preparation Products And Raw materials

Raw materials

Preparation Products

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Ethanol, 2-[[(3aR,4S,6R,6aS)-6-[[5-aMino-6-chloro-2-(propylthio)-4-pyriMidinyl]aMino]tetrahydro-2,2-diMethyl-4H-cyclopenta-1,3-dioxol-4-yl]oxy]- 2-[[(3aR,4S,6R,6aS)-6-[[5-Amino-6-chloro-2-(propylthio)-4-pyrimidinyl]amino]tetrahydro-2,2-dimethyl-4H-cyclopenta-1,3-dioxol-4-yl]oxy]-ethanol 2-(((3aR,4S,6R,6aS)-6-((5-aMino-6-chloro-2-(propylthio)pyriMidin-4-yl)aMino)-2,2-diMethyltetrahydro-3aH-cyclopenta[d][1,3]dioxol-4-yl)oxy)ethanol 2-(((3aR,4S,6R,6aS)-6-((5-amino-6-chloro-2-(propylthio)pyrimidin-4-yl)amino)-2,2-dimethyltetrahydro-4H-cyclopenta[d][1,3]dioxol-4-yl)oxy)ethan-1-ol Ticagrelor intermediate 12 Ticagrelor Impurity 48 Ticagrelor impurity 27/2-(((3aR,4S,6R,6aS)-6-((5-amino-6-chloro-2-(propylthio)pyrimidin-4-yl)amino)-2,2-dimethyltetrahydro-4H-cyclopenta[d][1,3]dioxol-4-yl)oxy)ethan-1-ol Ticagrelor-16 Ticagrelor Impurity 111 ETHANOL, 2-[[(3AR,4S,6R,6AS)-6-[[5- AMINO-6-CHLORO-2-(PROPYLTHIO) -4-PYRIMIDINYL]AMINO]TETRAHYDRO-2,2-DIMETHYL-4H-CYCLOPENTA-1,3-DIOX Ethanol, 2-[[(3aR,4S,6R,6aS)-6-[[5-amino-6-chloro-2-(propylt... 2-[[(3aR,4S,6R,6aS)-6-[[5-Amino-6-chloro-2-(propylthio)-4-pyrimidinyl]amino]tetrahydro-2,2-dimethyl- 2- (3AR, 4S, 6R, 6AS) -6- (5-amino-6-chloro-2-propylthio-4-pyrimidinyl) aminotetrahydro-2,2-dimethyl-4H-cyclopenteno-1,3-dioxocyclopentane-4-yl] oxygen] - ethanol (3aR,4S,6R,6aS)-2-[6-(5-Amino-6-chloro-2-propylsulfanyl-pyrimidin-4-ylamino)-2,2-dimethyl-tetrahydro-cyclopenta[1,3]dioxol-4-yloxy]-ethanol 2-(((3aR,4S,6R,6aS)-6-((5-Amino-6-chloro-2-(propylthio)pyrimidin-4-yl)amino)-2,2-dimethyltetrahydro-3aH-cyclopenta[d][1,3]dioxol-4-yl)oxy)ethanol? (Ticagrelor Impurity) 376608-74-1 C17H27ClN4O4S Pharmaceutical intermediates 376608-74-1