ChemicalBook--->CAS DataBase List--->42086-68-0

42086-68-0

42086-68-0 Structure

42086-68-0 Structure
IdentificationBack Directory
[Name]

Benzonitrile, 3-[(3-oxo-1(3H)-isobenzofuranylidene)methyl]-, (E)- (9CI)
[CAS]

42086-68-0
[Synonyms]

OlaparibImpurity42
Olaparib Impurity 73
[Molecular Formula]

C16H9NO2
[MOL File]

42086-68-0.mol
[Molecular Weight]

247.25
Chemical PropertiesBack Directory
[Boiling point ]

435.8±45.0 °C(Predicted)
[density ]

1.32±0.1 g/cm3(Predicted)
[InChI]

InChI=1S/C16H9NO2/c17-10-12-5-3-4-11(8-12)9-15-13-6-1-2-7-14(13)16(18)19-15/h1-9H/b15-9+
[InChIKey]

FCXMKELNVVARNC-OQLLNIDSSA-N
[SMILES]

C(#N)C1=CC=CC(/C=C2\C3=C(C=CC=C3)C(=O)O\2)=C1
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