IUPAC Name: | 2-fluoro-5-formylbenzonitrile |
Description: | 2-Fluoro-5-formylbenzonitrile (CAS# 218301-22-5) is used in the preparation of heterocyclic compounds as PARP inhibitors for medical use. |
Molecular Weight: | 149.12 |
Molecular Formula: | C8H4FNO |
Canonical SMILES: | C1=CC(=C(C=C1C=O)C#N)F |
InChI: | InChI=1S/C8H4FNO/c9-8-2-1-6(5-11)3-7(8)4-10/h1-3,5H |
InChI Key: | MOFRJTLODZILCR-UHFFFAOYSA-N |
Boiling Point: | 211.9 °C at 760 mmHg |
Melting Point: | 80-84 °C (lit.) |
Purity: | 98 % |
Density: | 1.265 g/cm3 |
MDL: | MFCD01863558 |
LogP: | 1.50988 |
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Related Functional Groups
Carbonyl Compounds
Fluorinated Building Blocks
2-(7,8-Difluoro-1-naphthyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane
Nitrogen Compounds
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