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Name |
9-Fluorononyl phenyl ketone |
EINECS | N/A |
CAS No. | 399-24-6 | Density | 0.968g/cm3 |
PSA | 17.07000 | LogP | 4.95960 |
Solubility | N/A | Melting Point |
N/A |
Formula | C16H23FO | Boiling Point | 344.4°Cat760mmHg |
Molecular Weight | 250.39 | Flash Point | 185.5°C |
Transport Information | N/A | Appearance | N/A |
Safety | A poison by intraperitoneal route. A flammable liquid. When heated to decomposition it emits toxic vapors of F− and Cl−. | Risk Codes | N/A |
Molecular Structure | Hazard Symbols | N/A | |
Synonyms |
10-Fluor-1-phenyl-decan-1-on;Decanophenone,10-fluoro;9-Fluorononyl phenyl ketone;10-fluoro-1-phenyl-decan-1-one; |
The Molecular Structure of 9-Fluorononyl phenyl ketone (CAS NO.399-24-6):
Molecular Formula: C16H23FO
Molecular Weight: 250.351623 g/mol
IUPAC: 10-fluoro-1-phenyldecan-1-one
Density: 0.968 g/cm3
Flash Point: 185.5 °C
Enthalpy of Vaporization: 58.83 kJ/mol
Boiling Point: 344.4 °C at 760 mmHg
Vapour Pressure: 6.61E-05 mmHg at 25°C
Polar Surface Area: 17.07Å2
Index of Refraction: 1.48
Molar Refractivity: 73.5 cm3
Molar Volume: 258.4 cm3
Surface Tension: 33.1 dyne/cm
ACD/LogP: 5.14
ACD/LogD (pH 5.5): 5.14
ACD/LogD (pH 7.4): 5.14
ACD/BCF (pH 5.5): 4737.77
ACD/BCF (pH 7.4): 4737.77
ACD/KOC (pH 5.5): 14878.83
ACD/KOC (pH 7.4): 14878.83
InChI: InChI=1/C16H23FO/c17-14-10-5-3-1-2-4-9-13-16(18)15-11-7-6-8-12-15/h6-8,11-12H,1-5,9-10,13-14H2
Smiles: C(=O)(c1ccccc1)CCCCCCCCCF
1. | ipr-mus LD50:90 mg/kg | JACSAT Journal of the American Chemical Society. 79 (1957),1959. |
A poison by intraperitoneal route. A flammable liquid. When heated to decomposition it emits toxic vapors of F− and Cl−.
DOT Classification: 3; Label: Flammable Liquid
9-Fluorononyl phenyl ketone (CAS NO.399-24-6) is also called as 4-07-00-00829 (Beilstein Handbook Reference) ; BRN 3276151 ; Decanophenone, 10-fluoro- .