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CAS No.: | 35143-75-0 |
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Name: | 5-Isoxazolamine,4-methyl-(9CI) |
Article Data: | 2 |
Molecular Structure: | |
Formula: | C4H6N2O |
Molecular Weight: | 98.10 |
Synonyms: | 5-Isoxazolamine,4-methyl-(9CI); |
Density: | 1.168 g/cm3 |
Boiling Point: | 233.187 °C at 760 mmHg |
Flash Point: | 94.828 °C |
PSA: | 52.05000 |
LogP: | 1.14640 |
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The 4-Methyl-5-isoxazolamine is an organic compound with the formula C4H6N2O. The systematic name of this chemical is 4-methyl-1,2-oxazol-5-amine. With the CAS registry number 35143-75-0, it is also named as 5-Isoxazolamine,4-methyl-(9CI). The product's category is Isoxazole.
Physical properties about 4-Methyl-5-isoxazolamine are: (1)ACD/LogP: 0.17 ; (2)ACD/BCF (pH 5.5): 1; (3)ACD/BCF (pH 7.4): 1; (4)ACD/KOC (pH 5.5): 24; (5)ACD/KOC (pH 7.4): 24; (6)#H bond acceptors: 3; (7)#H bond donors: 2; (8)#Freely Rotating Bonds: 1; (9)Polar Surface Area: 52.05 Å2; (10)Index of Refraction: 1.524; (11)Molar Refractivity: 25.705 cm3; (12)Molar Volume: 84.007 cm3; (13)Polarizability: 10.19×10-24cm3; (14)Surface Tension: 46.085 dyne/cm; (15)Density: 1.168 g/cm3; (16)Flash Point: 94.828 °C; (17)Enthalpy of Vaporization: 46.989 kJ/mol; (18)Boiling Point: 233.187 °C at 760 mmHg; (19)Vapour Pressure: 0.057 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: Nc1oncc1C
(2)InChI: InChI=1/C4H6N2O/c1-3-2-6-7-4(3)5/h2H,5H2,1H3
(3)InChIKey: GYNLTWUPSJGXFV-UHFFFAOYAT
(4)Std. InChI: InChI=1S/C4H6N2O/c1-3-2-6-7-4(3)5/h2H,5H2,1H3
(5)Std. InChIKey: GYNLTWUPSJGXFV-UHFFFAOYSA-N