9-Fluorenone

Details:

1.Introduction of 486-25-9

The CAS registry number of 9-fluorenone is 486-25-9. Its systematic name is 9H-Fluoren-9-one. It also has synonyms of fluorenone, fluorenone(9-), fluoren-9-one, AURORA KA-7498, 9H-fluorene-9-one. It belongs to product categories of fluorene derivatives, fluorenes, flurenones, fluorenes & fluorenones, fluorenones, functional materials, photopolymerization initiators, fused ring systems, C13 to C14, carbonyl compounds, ketones, OLED materials, pharm chemical, electronic chemical. Our product is a kind of yellow crystal powder, packed in 25 kg drum, and it is of high quality with purity of 99.0%.

2.Properties of 486-25-9

ACD/LogP: 3.489
# of Rule of 5 Violations: 0
ACD/LogD (pH 5.5): 3.49
ACD/LogD (pH 7.4): 3.49
ACD/BCF (pH 5.5): 263.83
ACD/BCF (pH 7.4): 263.83
ACD/KOC (pH 5.5): 1882.71
ACD/KOC (pH 7.4): 1882.71
#H bond acceptors: 1
#H bond donors: 0
#Freely Rotating Bonds: 0
Polar Surface Area: 17.07 ²
Index of Refraction: 1.667
Molar Refractivity: 53.926 cm³
Molar Volume: 144.83 cm³
Polarizability: 21.378 10-24cm³
Surface Tension: 52.3610000610352 dyne/cm
Density: 1.244 g/cm³
Flash Point: 144.142 °C
Enthalpy of Vaporization: 58.516 kJ/mol
Boiling Point: 341.499 °C at 760 mmHg
Vapour Pressure: 0 mmHg at 25°C

3.Structure Descriptors of 486-25-9

(1)InChI: InChI=1S/C13H8O/c14-13-11-7-3-1-5-9(11)10-6-2-4-8-12(10)13/h1-8H
(2)InChIKey: YLQWCDOCJODRMT-UHFFFAOYSA-N
(3)Canonical SMILES : C1=CC=C2C(=C1)C3=CC=CC=C3C2=O

4.Safety Information of 486-25-9

Hazard Codes: Xi
Risk Statements: 36/37/38
Safety Statements: 24/25-36/37/39-27-26
WGK Germany: 3
RTECS: LL8925000
Hazard Note: Irritant
HS Code: 29143900

5.Toxity of 486-25-9