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Name |
Benzamide,N-[4-bromo-2-(2-pyridinylcarbonyl)phenyl]- |
EINECS | 245-201-6 |
CAS No. | 22753-88-4 | Density | 1.49 g/cm3 |
PSA | 59.06000 | LogP | 4.40040 |
Solubility | N/A | Melting Point |
138-140 °C (decomp)(Solv: ethanol (64-17-5)) |
Formula | C19H13BrN2O2 | Boiling Point | 479.5 °C at 760 mmHg |
Molecular Weight | 381.228 | Flash Point | 243.8 °C |
Transport Information | N/A | Appearance | N/A |
Safety | Risk Codes | N/A | |
Molecular Structure | Hazard Symbols | N/A | |
Synonyms |
Benzanilide,4'-bromo-2'-picolinoyl- (7CI,8CI); |
The Benzamide,N-[4-bromo-2-(2-pyridinylcarbonyl)phenyl]- is an organic compound with the formula C19H13BrN2O2. The IUPAC name of this chemical is N-[5-bromo-2-(pyridine-2-carbonyl)phenyl]benzamide. With the CAS registry number 22753-88-4, it is also named as N-[4-Bromo-2-(pyridin-2-ylcarbonyl)phenyl]benzamide.
Physical properties about Benzamide,N-[4-bromo-2-(2-pyridinylcarbonyl)phenyl]- are: (1)ACD/LogP: 4.77; (2)ACD/LogD (pH 5.5): 4.77; (3)ACD/LogD (pH 7.4): 4.77; (4)ACD/BCF (pH 5.5): 2472.26; (5)ACD/BCF (pH 7.4): 2472.2; (6)ACD/KOC (pH 5.5): 9340.53; (7)ACD/KOC (pH 7.4): 9340.32; (8)#H bond acceptors: 4; (9)#H bond donors: 1; (10)#Freely Rotating Bonds: 4; (11)Polar Surface Area: 59.06 Å2; (12)Index of Refraction: 1.677; (13)Molar Refractivity: 96.4 cm3; (14)Molar Volume: 255.8 cm3; (15)Polarizability: 38.21×10-24cm3; (16)Surface Tension: 59.7 dyne/cm; (17)Density: 1.49 g/cm3; (18)Flash Point: 243.8 °C; (19)Enthalpy of Vaporization: 74.38 kJ/mol; (20)Boiling Point: 479.5 °C at 760 mmHg; (21)Vapour Pressure: 2.35E-09 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: O=C(c2cc(Br)ccc2NC(=O)c1ccccc1)c3ccccn3
(2)InChI: InChI=1/C19H13BrN2O2/c20-14-9-10-16(22-19(24)13-6-2-1-3-7-13)15(12-14)18(23)17-8-4-5-11-21-17/h1-12H,(H,22,24)
(3)InChIKey: JBFBLJZYATVKLI-UHFFFAOYAX
(4)Std. InChI: InChI=1S/C19H13BrN2O2/c20-14-9-10-16(22-19(24)13-6-2-1-3-7-13)15(12-14)18(23)17-8-4-5-11-21-17/h1-12H,(H,22,24)
(5)Std. InChIKey: JBFBLJZYATVKLI-UHFFFAOYSA-N