Basic Information | Post buying leads | Suppliers |
Name |
6-Methylindole-2-carboxylic acid |
EINECS | 125-856-9 |
CAS No. | 886372-98-1 | Density | 1.923 g/cm3 |
PSA | 58.71000 | LogP | 2.41460 |
Solubility | N/A | Melting Point |
N/A |
Formula | C5H2BrFN2O2 | Boiling Point | 272.8 °C at 760 mmHg |
Molecular Weight | 220.9839832 | Flash Point | 118.8 °C |
Transport Information | N/A | Appearance | N/A |
Safety | Risk Codes | 22 | |
Molecular Structure | Hazard Symbols | Xn | |
Synonyms |
5-bromo-2-fluoro-3-nitropyridine |
The Pyridine,5-bromo-2-fluoro-3-nitro- is an organic compound with the formula C5H2BrFN2O2. The systematic name of this chemical is pyridine, 5-bromo-2-fluoro-3-nitro-. With the CAS registry number 886372-98-1, it is also named as 5-Bromo-2-Fluoro-3-Nitropyridine.
Physical properties about Pyridine,5-bromo-2-fluoro-3-nitro- are: (1)ACD/LogP: 1.13; (2)ACD/LogD (pH 5.5): 1.13; (3)ACD/LogD (pH 7.4): 1.13; (4)ACD/BCF (pH 5.5): 4.25; (5)ACD/BCF (pH 7.4): 4.25; (6)ACD/KOC (pH 5.5): 98.12; (7)ACD/KOC (pH 7.4): 98.12; (8)#H bond acceptors: 4 ; (9)#Freely Rotating Bonds: 1; (10)Polar Surface Area: 58.71 Å2; (11)Index of Refraction: 1.586; (12)Molar Refractivity: 38.57 cm3; (13)Molar Volume: 114.8 cm3; (14)Polarizability: 15.29×10-24cm3; (15)Surface Tension: 56.1 dyne/cm; (16)Density: 1.923 g/cm3; (17)Flash Point: 118.8 °C; (18)Enthalpy of Vaporization: 49.05 kJ/mol; (19)Boiling Point: 272.8 °C at 760 mmHg; (20)Vapour Pressure: 0.00994 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: c1c(cnc(c1[N+](=O)[O-])F)Br
(2)InChI: InChI=1/C5H2BrFN2O2/c6-3-1-4(9(10)11)5(7)8-2-3/h1-2H
(3)InChIKey: SGDKTJPVCKQTHK-UHFFFAOYAK
(4)Std. InChI: InChI=1S/C5H2BrFN2O2/c6-3-1-4(9(10)11)5(7)8-2-3/h1-2H
(5)Std. InChIKey: SGDKTJPVCKQTHK-UHFFFAOYSA-N