3-Acetyl-2-fluoropyridine supplier

Name
3-Acetyl-2-fluoropyridine
EINECS
CAS No. 79574-70-2
Article Data6
CAS DataBase
Density 1.175 g/cm³
Solubility
Melting Point
Formula C₇H₆FNO
Boiling Point 232.4 °C at 760 mmHg
Molecular Weight 139.129
Flash Point 94.4 °C
Transport Information
Appearance
Safety 26
Risk Codes 22-36
Molecular Structure
Hazard Symbols Xi
Synonyms 1-(2-Fluoropyridin-3-yl)ethanone;1-(2-Fluoropyridin-3-yl)ethan-1-one;
PSA 29.96000
LogP 1.42330

3-Acetyl-2-fluoropyridine Specification

The IUPAC name of 3-Acetyl-2-fluoropyridine is 1-(2-fluoropyridin-3-yl)ethanone. With the CAS registry number 79574-70-2, it is also named as Ethanone,1-(2-fluoro-3-pyridinyl)-. The product's categories are Acetyl Group; Pyridine; API Intermediates; Acetyl; Building Blocks. In addition, its molecular formula is C₇H₆FNO and molecular weight is 139.13.

The other characteristics of 3-Acetyl-2-fluoropyridine can be summarized as: (1)ACD/LogP: 0.16; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 0.16; (4)ACD/LogD (pH 7.4): 0.16; (5)ACD/BCF (pH 5.5): 1; (6)ACD/BCF (pH 7.4): 1; (7)ACD/KOC (pH 5.5): 29.08; (8)ACD/KOC (pH 7.4): 29.08; (9)#H bond acceptors: 2; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 1; (12)Polar Surface Area: 29.96 Å²; (13)Index of Refraction: 1.492; (14)Molar Refractivity: 34.36 cm³; (15)Molar Volume: 118.3 cm³; (16)Polarizability: 13.62×10^-24cm³; (17)Surface Tension: 37.8 dyne/cm; (18)Density: 1.175 g/cm³; (19)Flash Point: 94.4 °C; (20)Enthalpy of Vaporization: 46.91 kJ/mol; (21)Boiling Point: 232.4 °C at 760 mmHg; (22)Vapour Pressure: 0.059 mmHg at 25 °C.

People can use the following data to convert to the molecule structure.
(1)SMILES: O=C(C)c1cccnc1F
(2)InChI: InChI=1/C7H6FNO/c1-5(10)6-3-2-4-9-7(6)8/h2-4H,1H3
(3)InChIKey: KEEHTCBOJCVCNO-UHFFFAOYAB
(4)Std. InChI: InChI=1S/C7H6FNO/c1-5(10)6-3-2-4-9-7(6)8/h2-4H,1H3
(5)Std. InChIKey: KEEHTCBOJCVCNO-UHFFFAOYSA-N

Product Name

3-Acetyl-2-fluoropyridine

3-Acetyl-2-fluoropyridine Specification

Related Products

Hot Products