4-(4-fluorophenyl)-3-[(E)-2-[(2S,4R)-4-hydroxy-6-oxooxan-2-yl]ethenyl]-2-propan-2-ylisoquinolin-1-one

Modify Date: 2024-01-22 18:51:32

4-(4-fluorophenyl)-3-[(E)-2-[(2S,4R)-4-hydroxy-6-oxooxan-2-yl]ethenyl]-2-propan-2-ylisoquinolin-1-one Structure
4-(4-fluorophenyl)-3-[(E)-2-[(2S,4R)-4-hydroxy-6-oxooxan-2-yl]ethenyl]-2-propan-2-ylisoquinolin-1-one structure
Common Name 4-(4-fluorophenyl)-3-[(E)-2-[(2S,4R)-4-hydroxy-6-oxooxan-2-yl]ethenyl]-2-propan-2-ylisoquinolin-1-one
CAS Number 126059-69-6 Molecular Weight 421.46100
Density 1.367g/cm3 Boiling Point 632.1ºC at 760 mmHg
Molecular Formula C25H24FNO4 Melting Point N/A
MSDS N/A Flash Point 336.1ºC

 Names

Name 4-(4-fluorophenyl)-3-[(E)-2-[(2S,4R)-4-hydroxy-6-oxooxan-2-yl]ethenyl]-2-propan-2-ylisoquinolin-1-one
Synonym More Synonyms

 Chemical & Physical Properties

Density 1.367g/cm3
Boiling Point 632.1ºC at 760 mmHg
Molecular Formula C25H24FNO4
Molecular Weight 421.46100
Flash Point 336.1ºC
Exact Mass 421.16900
PSA 68.53000
LogP 4.46820
Vapour Pressure 7.55E-17mmHg at 25°C
Index of Refraction 1.685
InChIKey NNYJKTFIAUUWRQ-MCBHFWOFSA-N
SMILES CC(C)n1c(C=CC2CC(O)CC(=O)O2)c(-c2ccc(F)cc2)c2ccccc2c1=O

 Synonyms

6-(2-(4-(4-Fluorophenyl)-2-isopropyl-1-oxo-1,2-dihydroisoquinolin-3-yl)ethen-1-yl)-4-hydroxy-3,4,5,6-tetrahydro-2H-pyran-2-one
1(2H)-Isoquinolinone,4-(4-fluorophenyl)-2-(1-methylethyl)-3-(2-(tetrahydro-4-hydroxy-6-oxo-2H-pyran-2-yl)ethenyl)-,(2S-(2alpha(E),4beta))
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