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CAS No.: | 212268-13-8 |
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Name: | 6-FLUORO-3,4-PYRIDINEDIAMINE |
Article Data: | 8 |
Molecular Structure: | |
Formula: | C5H6FN3 |
Molecular Weight: | 127.121 |
Synonyms: | 2,3-Diamino-5-Fluoropyridine; |
EINECS: | 200-258-5 |
Density: | 1.39 g/cm3 |
Boiling Point: | 303.852 °C at 760 mmHg |
Flash Point: | 137.565 °C |
PSA: | 64.93000 |
LogP: | 1.54750 |
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The 2,3-Pyridinediamine,5-fluoro-, with the CAS registry number of 212268-13-8, is also known as 2,3-Diamino-5-Fluoropyridine. It belongs to the product categories of Pyridine; Amineprimary. This chemical's molecular formula is C5H6FN3 and molecular weight is 127.1196432. What's more, its systematic name is 5-Fluoropyridine-2,3-diamine.
Physical properties about the 2,3-Pyridinediamine,5-fluoro- are: (1)ACD/LogP: 0.20; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 1; (4)ACD/LogD (pH 7.4): 1; (5)ACD/BCF (pH 5.5): 3; (6)ACD/BCF (pH 7.4): 3; (7)ACD/KOC (pH 5.5): 68; (8)ACD/KOC (pH 7.4): 71; (9)#H bond acceptors: 3; (10)#H bond donors: 4; (11)#Freely Rotating Bonds: 1; (12)Polar Surface Area: 64.93 Å2; (13)Index of Refraction: 1.637; (14)Molar Refractivity: 32.81 cm3; (15)Molar Volume: 91.427 cm3; (16)Surface Tension: 65.617 dyne/cm; (17)Density: 1.39 g/cm3; (18)Flash Point: 137.565 °C; (19)Enthalpy of Vaporization: 54.417 kJ/mol; (20)Boiling Point: 303.852 °C at 760 mmHg; (21)Vapour Pressure: 0.001 mmHg at 25 °C.
You can still convert the following datas into molecular structure:
(1) SMILES: Fc1cnc(N)c(N)c1
(2) InChI: InChI=1/C5H6FN3/c6-3-1-4(7)5(8)9-2-3/h1-2H,7H2,(H2,8,9)
(3) InChIKey: MGBUJACQIBNLAU-UHFFFAOYAC