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Name |
Acetamide,N-(3-bromo-5-fluoro-2-pyridinyl)- |
EINECS | N/A |
CAS No. | 1065074-95-4 | Density | 1.711 g/cm3 |
PSA | 41.99000 | LogP | 2.01460 |
Solubility | N/A | Melting Point |
N/A |
Formula | C7H6BrFN2O | Boiling Point | 338.7 °C at 760 mmHg |
Molecular Weight | 233.04 | Flash Point | 158.6 °C |
Transport Information | N/A | Appearance | N/A |
Safety | Risk Codes | N/A | |
Molecular Structure | Hazard Symbols | N/A | |
Synonyms |
2-Acetamido-3-Bromo-5-Fluoropyridine;N-(3-Bromo-5-fluoropyridin-2-yl)acetamide; |
The Acetamide,N-(3-bromo-5-fluoro-2-pyridinyl)-, with the CAS registry number 1065074-95-4, is also known as 2-Acetamido-3-bromo-5-fluoropyridine. This chemical's molecular formula is C7H6BrFN2O and molecular weight is 233.04. What's more, its systematic name is N-(3-Bromo-5-fluoropyridin-2-yl)acetamide.
Physical properties of Acetamide,N-(3-bromo-5-fluoro-2-pyridinyl)- are: (1)ACD/LogP: 1.33; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 1.33; (4)ACD/LogD (pH 7.4): 1.33; (5)ACD/BCF (pH 5.5): 6.05; (6)ACD/BCF (pH 7.4): 6.05; (7)ACD/KOC (pH 5.5): 126.23; (8)ACD/KOC (pH 7.4): 126.23; (9)#H bond acceptors: 3; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 0; (12)Polar Surface Area: 41.99 Å2; (13)Index of Refraction: 1.595; (14)Molar Refractivity: 46.3 cm3; (15)Molar Volume: 136.1 cm3; (16)Polarizability: 18.35×10-24 cm3; (17)Surface Tension: 50.4 dyne/cm; (18)Density: 1.711 g/cm3; (19)Flash Point: 158.6 °C; (20)Enthalpy of Vaporization: 58.21 kJ/mol; (21)Boiling Point: 338.7 °C at 760 mmHg; (22)Vapour Pressure: 9.66E-05 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: CC(=O)Nc1c(cc(cn1)F)Br
(2)InChI: InChI=1/C7H6BrFN2O/c1-4(12)11-7-6(8)2-5(9)3-10-7/h2-3H,1H3,(H,10,11,12)
(3)InChIKey: GGDXFTPHNXSROV-UHFFFAOYAP