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CAS No.: | 165744-15-0 |
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Name: | 5-ETHYL-1-METHYL-1H-PYRAZOLE-3-CARBOXYLIC ACID |
Molecular Structure: | |
Formula: | C7H10N2O2 |
Molecular Weight: | 154.169 |
Synonyms: | AKOS PAO-0919;5-ETHYL-1-METHYL-1H-PYRAZOLE-3-CARBOXYLIC ACID;1H-Pyrazole-3-carboxylicacid,5-ethyl-1-methyl-(9CI) |
EINECS: | 604-604-1 |
Density: | 1.234 g/cm3 |
Boiling Point: | 320.839 °C at 760 mmHg |
Flash Point: | 147.839 °C |
PSA: | 55.12000 |
LogP: | 0.68070 |
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The 1H-Pyrazole-3-carboxylicacid, 5-ethyl-1-methyl- is an organic compound with the formula C7H10N2O2. The IUPAC name of this chemical is 5-Ethyl-1-methylpyrazole-3-carboxylic acid. With the CAS registry number 165744-15-0, it is also named as 5-Ethyl-1-methyl-1H-pyrazole-3-carboxylic acid. The product's categories are Glycinescaffold; Carboxylicacid. Besides, its molecular weight is 154.17.
Physical properties about 1H-Pyrazole-3-carboxylicacid, 5-ethyl-1-methyl- are: (1)ACD/LogP: 1.53; (2)ACD/BCF (pH 5.5): 1; (3)ACD/BCF (pH 7.4): 1; (4)ACD/KOC (pH 5.5): 9; (5)ACD/KOC (pH 7.4): 1; (6)#H bond acceptors: 4; (7)#H bond donors: 1; (8)#Freely Rotating Bonds: 2; (9)Polar Surface Area: 55.12 Å2; (10)Index of Refraction: 1.563; (11)Molar Refractivity: 40.596 cm3; (12)Molar Volume: 124.94 cm3; (13)Polarizability: 16.094×10-24 cm3; (14)Surface Tension: 43.033 dyne/cm; (15)Density: 1.234 g/cm3; (16)Flash Point: 147.839 °C; (17)nthalpy of Vaporization: 59.388 kJ/mol; (18)Boiling Point: 320.839 °C at 760 mmHg.
You can still convert the following datas into molecular structure:
(1)InChI: InChI=1/C7H10N2O2/c1-3-5-4-6(7(10)11)8-9(5)2/h4H,3H2,1-2H3,(H,10,11)
(2)InChIKey: UXDZNQXVCFIDJL-UHFFFAOYAR
(3)Std. InChI: InChI=1S/C7H10N2O2/c1-3-5-4-6(7(10)11)8-9(5)2/h4H,3H2,1-2H3,(H,10,11)
(4)Std. InChIKey: UXDZNQXVCFIDJL-UHFFFAOYSA-N