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CAS No.: | 4269-20-9 |
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Name: | 4-CYANO-9-FLUORENONE, 99.5+% |
Article Data: | 6 |
Molecular Structure: | |
Formula: | C14H7NO |
Molecular Weight: | 205.216 |
Synonyms: | Fluorene-4-carbonitrile,9-oxo- (7CI,8CI);4-Cyanofluoren-9-one;4-Cyanofluorenone;NSC 134568;4-Cyano-9-fluorenone;9-Oxo-9H-fluorene-4-carbonitrile; |
Density: | 1.33 g/cm3 |
Melting Point: | 244°C |
Boiling Point: | 405.8 °C at 760 mmHg |
Flash Point: | 199.2 °C |
Appearance: | Yellow crystalline powder |
PSA: | 40.86000 |
LogP: | 2.76968 |
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The 9H-Fluorene-4-carbonitrile,9-oxo-, with the CAS registry number 4269-20-9, is also known as 4-Cyano-9-fluorenone. This chemical's molecular formula is C14H7NO and molecular weight is 205.21. What's more, its systematic name is 9-Oxo-9H-fluorene-4-carbonitrile.
Physical properties of 9H-Fluorene-4-carbonitrile,9-oxo- are: (1)ACD/LogP: 3.02; (2)# of Rule of 5 Violations: 0; (3)#H bond acceptors: 2; (4)#H bond donors: 0; (5)#Freely Rotating Bonds: 0; (6)Polar Surface Area: 40.86 Å2; (7)Index of Refraction: 1.687; (8)Molar Refractivity: 58.71 cm3; (9)Molar Volume: 154 cm3; (10)Polarizability: 23.27×10-24 cm3; (11)Surface Tension: 64.9 dyne/cm; (12)Density: 1.33 g/cm3; (13)Flash Point: 199.2 °C; (14)Enthalpy of Vaporization: 65.75 kJ/mol; (15)Boiling Point: 405.8 °C at 760 mmHg; (16)Vapour Pressure: 8.52E-07 mmHg at 25°C.
Uses of 9H-Fluorene-4-carbonitrile,9-oxo-: it can be used to produce 9-hydroxy-9H-fluorene-4-carbonitrile at the temperature of 25 °C. It will need reagent NaBH4 and solvent tetrahydrofuran with the reaction time of 1.5 hours. The yield is about 87%.
You can still convert the following datas into molecular structure:
(1)Canonical SMILES: C1=CC=C2C(=C1)C3=C(C=CC=C3C2=O)C#N
(2)InChI: InChI=1S/C14H7NO/c15-8-9-4-3-7-12-13(9)10-5-1-2-6-11(10)14(12)16/h1-7H
(3)InChIKey: GYZWHNSTYWQGPP-UHFFFAOYSA-N