ChemicalBook--->CAS DataBase List--->1350643-72-9

1350643-72-9

1350643-72-9 Structure

1350643-72-9 Structure
IdentificationBack Directory
[Name]

Duvelisib int
[CAS]

1350643-72-9
[Synonyms]

Duvelisib int
Duvelisib int (IPi-145 int )
(S)-3-(1-aminoethyl)-isoquinolin-1(2H)-one
3-[(1S)-1-aminoethyl]-8-chloro-2-phenylisoquinolin-1-one
(S)-3-(1-aninoehyl)-8-chloro-2-phenylisoquinolin-1(2H)-one
(S)-3-(1-aminoethyl)-8-chloro-2-phenylisoquinolin-1(2H)-one
3-[(1S)-1-aminoethyl]-8-chloro-2-phenyl-1(2H)-Isoquinolinone
1(2H)-Isoquinolinone, 3-[(1S)-1-aminoethyl]-8-chloro-2-phenyl-
3-[(1S)-1-aminoethyl]-8-chloro-2-phenyl-1,2-dihydroisoquinolin-1-one
[EINECS(EC#)]

813-285-9
[Molecular Formula]

C17H15ClN2O
[MDL Number]

MFCD23166427
[MOL File]

1350643-72-9.mol
[Molecular Weight]

298.77
Chemical PropertiesBack Directory
[Boiling point ]

477.9±45.0 °C(Predicted)
[density ]

1.296±0.06 g/cm3(Predicted)
[storage temp. ]

Keep in dark place,Inert atmosphere,Store in freezer, under -20°C
[pka]

10.59±0.29(Predicted)
[Appearance]

pale yellow solid
[InChI]

InChI=1S/C17H15ClN2O/c1-11(19)15-10-12-6-5-9-14(18)16(12)17(21)20(15)13-7-3-2-4-8-13/h2-11H,19H2,1H3/t11-/m0/s1
[InChIKey]

MZINZXIFJMLTOK-NSHDSACASA-N
[SMILES]

C1(=O)C2=C(C=CC=C2Cl)C=C([C@@H](N)C)N1C1=CC=CC=C1
Safety DataBack Directory
[Symbol(GHS) ]

Exclamation Mark (GHS07)
GHS07
[Signal word ]

Warning
[Hazard statements ]

H302-H315-H319-H335
[Precautionary statements ]

P261-P305+P351+P338
Questions And AnswerBack Directory
[Application]

IPI145 intermediates can be used as intermediates in organic synthesis and pharmaceutical processes, and are mainly used in laboratory organic synthesis processes and chemical and pharmaceutical research and development.
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