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CAS No.: | 75291-86-0 |
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Name: | 2,5-Dichloronicotinamide |
Article Data: | 4 |
Molecular Structure: | |
Formula: | C6H4Cl2N2O |
Molecular Weight: | 191.017 |
Synonyms: | 2,5-Dichloronicotinamide; |
Density: | 1.524 g/cm3 |
Boiling Point: | 280.9 °C at 760 mmHg |
Flash Point: | 123.7 °C |
Hazard Symbols: | Xi |
PSA: | 55.98000 |
LogP: | 2.18760 |
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The 2,5-Dichloronicotinamide, with the CAS registry number 75291-86-0, is also known as 3-Pyridinecarboxamide, 2,5-dichloro-. It belongs to the product category of Pyridines. This chemical's molecular formula is C6H4Cl2N2O and molecular weight is 191.01. Its systematic name is called 2,5-dichloropyridine-3-carboxamide. When you are using this chemical, please be cautious about it. It may cause inflammation to the skin or other mucous membranes.
Physical properties of 2,5-Dichloronicotinamide: (1)ACD/LogP: 1.10; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 1.1; (4)ACD/LogD (pH 7.4): 1.1; (5)ACD/BCF (pH 5.5): 4.05; (6)ACD/BCF (pH 7.4): 4.05; (7)ACD/KOC (pH 5.5): 94.69; (8)ACD/KOC (pH 7.4): 94.69; (9)#H bond acceptors: 3; (10)#H bond donors: 2; (11)#Freely Rotating Bonds: 1; (12)Index of Refraction: 1.603; (13)Molar Refractivity: 43.06 cm3; (14)Molar Volume: 125.2 cm3; (15)Surface Tension: 59.2 dyne/cm; (16)Density: 1.524 g/cm3; (17)Flash Point: 123.7 °C; (18)Enthalpy of Vaporization: 51.97 kJ/mol; (19)Boiling Point: 280.9 °C at 760 mmHg; (20)Vapour Pressure: 0.00367 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: O=C(c1cc(Cl)cnc1Cl)N
(2)InChI: InChI=1/C6H4Cl2N2O/c7-3-1-4(6(9)11)5(8)10-2-3/h1-2H,(H2,9,11)
(3)InChIKey: ZFKLQPMSJKTZDR-UHFFFAOYAE