CAS No.651735-59-0,7-Fluoro-1-indanone Suppliers

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Basic Information

Molecular Structure:
CAS No.:	651735-59-0
Name:	7-Fluoro-1-indanone
Article Data:	9

Formula:	C₉H₇FO
Molecular Weight:	150.152
Synonyms:	7-Fluoro-1-indanone;7-Fluorindan-1-on;7-fluoroindan-1-one;
Density:	1.259 g/cm³
Boiling Point:	245.139 °C at 760 mmHg
Flash Point:	86.764 °C
PSA:	17.07000
LogP:	1.95460

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Specification

The 1H-Inden-1-one,7-fluoro-2,3-dihydro-, with the cas registry number 651735-59-0, has the IUPAC name of 7-fluoro-2,3-dihydroinden-1-one. And its product categories are including halide; cyclopentane.

The characteristics of this chemical are as follows: (1)ACD/LogP: 2.15; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 2.15; (4)ACD/LogD (pH 7.4): 2.15; (5)ACD/BCF (pH 5.5): 25.39; (6)ACD/BCF (pH 7.4): 25.39; (7)ACD/KOC (pH 5.5): 352.43; (8)ACD/KOC (pH 7.4): 352.43; (9)#H bond acceptors: 1; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 0; (12)Polar Surface Area: 17.07; (13)Index of Refraction: 1.559; (14)Molar Refractivity: 38.55 cm³; (15)Molar Volume: 119.2 cm³; (16)Polarizability: 15.28 ×10^-24 cm³; (17)Surface Tension: 42.8 dyne/cm; (18)Density: 1.259 g/cm³; (19)Flash Point: 86.8 °C; (20)Enthalpy of Vaporization: 48.22 kJ/mol; (21)Boiling Point: 245.1 °C at 760 mmHg; (22)Vapour Pressure: 0.0292 mmHg at 25°C; (23)Exact Mass: 150.048093; (24)MonoIsotopic Mass: 150.048093; (25)Topological Polar Surface Area: 17.1; (26)Heavy Atom Count: 11; (27)Formal Charge: 0; (28)Complexity: 178.

Additionally, you could convert the following datas into the molecular structure:
(1)Canonical SMILES: C1CC(=O)C2=C1C=CC=C2F
(2)InChI: InChI=1S/C9H7FO/c10-7-3-1-2-6-4-5-8(11)9(6)7/h1-3H,4-5H2
(3)InChIKey: ASSCRDJQEHFKSX-UHFFFAOYSA-N