CAS No.6344-60-1,1-HYDROXY-9-FLUORENONE Suppliers

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Basic Information

Molecular Structure:
CAS No.:	6344-60-1
Name:	1-HYDROXY-9-FLUORENONE
Article Data:	15

Formula:	C₁₃H₈O₂
Molecular Weight:	196.205
Synonyms:	Fluoren-9-one,1-hydroxy- (⁶CI,⁸CI);1-Hydroxyfluoren-9-one;1-Hydroxyfluorenone;NSC 51309;
EINECS:	228-746-4
Density:	1.369 g/cm³
Melting Point:	116-119 °C
Boiling Point:	383.4 °C at 760 mmHg
Flash Point:	163.7 °C
Appearance:	yellow to orange crystalline solid
Hazard Symbols:	Xi
Risk Codes:	36/37/38
Safety:	37/39-26
PSA:	37.30000
LogP:	2.60360

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Specification

This chemical is called 9H-Fluoren-9-one,1-hydroxy-, and its systematic name is 1-hydroxy-9H-fluoren-9-one. With the molecular formula of C₁₃H₈O₂, its molecular weight is 196.2. The CAS registry number of this chemical is 6344-60-1. In addition, this chemical should be sealed in the cool and dry place, away from oxides.

Other characteristics of the ³H-Fluoren-9-one,1-hydroxy- can be summarised as followings: (1)LogP: 3.87; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 3.87; (4)ACD/LogD (pH 7.4): 3.7; (5)ACD/BCF (pH 5.5): 511.88; (6)ACD/BCF (pH 7.4): 346.7; (7)ACD/KOC (pH 5.5): 3020.46; (8)ACD/KOC (pH 7.4): 2045.78; (9)#H bond acceptors: 2; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 1; (12)Polar Surface Area: 26.3 Å²; (13)Index of Refraction: 1.707; (14)Molar Refractivity: 55.8 cm³; (15)Molar Volume: 143.2 cm³; (16)Polarizability: 22.12× 10^-24cm³; (17)Surface Tension: 63.7 dyne/cm; (18)Density: 1.369 g/cm³; (19)Flash Point: 163.7 °C; (20)Enthalpy of Vaporization: 65.67 kJ/mol; (21)Boiling Point: 383.4 °C at 760 mmHg; (22)Vapour Pressure: 2E-06 mmHg at 25°C.

Production method of this chemical: The 9H-Fluoren-9-one,1-hydroxy- could be obtained by the reactant of 1-methoxy-fluoren-9-one. This reaction needs the reagent of BBr3, and the solvent of CH₂Cl₂. The yield is 95 %. In addition, this reaction should be taken for 12 hours at the temperature of -78-20 °C.

The <sup>9</sup>H-Fluoren-9-one,1-hydroxy- could be obtained by the reactant of 1-methoxy-fluoren-9-one.

Uses of this chemical: The 9H-Fluoren-9-one,1-hydroxy- could react with phenol, and obtain the 9,9-bis-(4-hydroxy-phenyl)-9H-fluoren-3-ol. This reaction needs the reagent of AlCl₃. The yield is 35 %. In addition, this reaction should be taken for 4 hours at the temperature of 160 °C.

The <sup>9</sup>H-Fluoren-9-one,1-hydroxy- could react with phenol, and obtain the 9,9-bis-(4-hydroxy-phenyl)-9H-fluoren-3-ol.

When you are using this chemical, please be cautious about it as the following:This chemical is irritating to eyes, respiratory system and skin. You should wear suitable protective clothing, gloves and eye/face protection if you use it. In case of contact with eyes, rinse immediately with plenty of water and seek medical advice.

You can still convert the following datas into molecular structure:
1.SMILES: O=C2c3c(c1cccc(O)c12)cccc3
2.InChI: InChI=1/C13H8O2/c14-11-7-3-6-9-8-4-1-2-5-10(8)13(15)12(9)11/h1-7,14H
3.InChIKey: QUUNMPSDKIURJD-UHFFFAOYAF
4.Std. InChI: InChI=1S/C13H8O2/c14-11-7-3-6-9-8-4-1-2-5-10(8)13(15)12(9)11/h1-7,14H
5.Std. InChIKey: QUUNMPSDKIURJD-UHFFFAOYSA-N