2-Fluoro-5-[(3-oxo-1(3H)-isobenzofuranylidene)methyl]-benzonitrile

2-Fluoro-5-[(3-oxo-1(3H)-isobenzofuranylidene)methyl]-benzonitrile Basic information

Product Name:	2-Fluoro-5-[(3-oxo-1(3H)-isobenzofuranylidene)methyl]-benzonitrile
Synonyms:	2-Fluoro-5-[(3-oxo-1(3H)-isobenzofuranylidene)methyl]-benzonitrile;2-fluoro-5-(3-oxo-1,3-dihydroisobenzofuranylidene methyl)benzonitrile;(E)-2-fluoro-5-((3-oxoisobenzofuran-1(3H)-ylidene)methyl)benzonitrile;Benzonitrile, 2-fluoro-5-[(3-oxo-1(3H)-isobenzofuranylidene)methyl]-;2-Fluoro-5-[(3-oxo-1(3H)-isobenzofuranylidene)meth;2-Fluoro-5-[(3-oxo-1(3H)-isobenzofuranylidene)methyl]benzoni...;2-fluoro-5-[(3-oxo-1,3-dihydro-2-benzofuran-1-ylidene)methyl]benzonitrile;C16H8FNO2 2-Fluoro-5-[(3-oxo-1(3H)-isobenzofuranylidene)methyl]-benzonitrile 763114-25-6
CAS:	763114-25-6
MF:	C16H8FNO2
MW:	265.24
EINECS:
Product Categories:	trebectedin
Mol File:	763114-25-6.mol

2-Fluoro-5-[(3-oxo-1(3H)-isobenzofuranylidene)methyl]-benzonitrile Chemical Properties

Boiling point	430.1±45.0 °C(Predicted)
density	1.38
storage temp.	Sealed in dry,Room Temperature
solubility	Dichloromethane, Tetrahydrofuran
form	Solid
color	White
InChI	InChI=1S/C16H8FNO2/c17-14-6-5-10(7-11(14)9-18)8-15-12-3-1-2-4-13(12)16(19)20-15/h1-8H
InChIKey	MMPHWTMMVPBHRZ-UHFFFAOYSA-N
SMILES	C(#N)C1=CC(C=C2C3=C(C=CC=C3)C(=O)O2)=CC=C1F

Safety Information

HS Code

2932990090

MSDS Information

2-Fluoro-5-[(3-oxo-1(3H)-isobenzofuranylidene)methyl]-benzonitrile Usage And Synthesis

Chemical Properties	White Solid
Uses	Intermediate in the preparation of poly (ADP-ribose) polymerase (PARP) inhibitors.

2-Fluoro-5-[(3-oxo-1(3H)-isobenzofuranylidene)methyl]-benzonitrile Preparation Products And Raw materials

Raw materials	Benzonitrile, 5-ethenyl-2-fluoro--->3-oxo-1,3-dihydroisobenzofuran-1-ylphosphonic acid-->2-FLUORO-5-FORMYLBENZONITRILE
Preparation Products	2-Fluoro-5-((4-oxo-3,4-dihydrophthalazin-1-yl)Methyl)benzonitrile-->2-fluoro-5-((4-oxo-3,4-dihydrophthalazin-1-yl)Methyl)benzoic acid

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