ChemicalBook--->CAS DataBase List--->118313-35-2

118313-35-2

118313-35-2 Structure

118313-35-2 Structure
IdentificationBack Directory
[Name]

5-METHOXY-2H-ISOQUINOLIN-1-ONE
[CAS]

118313-35-2
[Synonyms]

5-methoxyisoquinolin-1-ol
5-METHOXY-2H-ISOQUINOLIN-1-ONE
5-methoxyisoquinolin-1(2H)-one
5-methoxy-2H-isoquinoline-1-one
1(2H)-Isoquinolinone, 5-methoxy-
[Molecular Formula]

C10H9NO2
[MDL Number]

MFCD00713157
[MOL File]

118313-35-2.mol
[Molecular Weight]

175.18
Chemical PropertiesBack Directory
[Melting point ]

222-224 °C(Solv: ethyl acetate (141-78-6))
[Boiling point ]

438.5±45.0 °C(Predicted)
[density ]

1.199±0.06 g/cm3(Predicted)
[pka]

12.79±0.20(Predicted)
[InChI]

InChI=1S/C10H9NO2/c1-13-9-4-2-3-8-7(9)5-6-11-10(8)12/h2-6H,1H3,(H,11,12)
[InChIKey]

JTIMZAUBSBUCNK-UHFFFAOYSA-N
[SMILES]

C1(=O)C2=C(C(OC)=CC=C2)C=CN1
Safety DataBack Directory
[Hazard Codes ]

Xn
[Risk Statements ]

22
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5154-02-9

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