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CAS No.: | 926921-71-3 |
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Name: | (4-Bromo-1-methyl-1H-pyrazol-3-yl)methylamine |
Molecular Structure: | |
Formula: | C5H8BrN3 |
Molecular Weight: | 190.0411 |
Synonyms: | 3-(Aminomethyl)-4-bromo-1-methyl-1H-pyrazole; |
EINECS: | 604-604-1 |
Density: | 1.756 g/cm3 |
Boiling Point: | 284.87 °C at 760 mmHg |
Flash Point: | 126.085 °C |
Hazard Symbols: | C |
PSA: | 43.84000 |
LogP: | 1.34160 |
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The 1H-Pyrazole-3-methanamine,4-bromo-1-methyl-, with the CAS registry number 926921-71-3, is also known as 3-(Aminomethyl)-4-bromo-1-methyl-1H-pyrazole. This chemical's molecular formula is C5H8BrN3 and molecular weight is 190.0411. Its systematic name is called 1-(4-bromo-1-methyl-1H-pyrazol-3-yl)methanamine. When you are using this chemical, please be cautious about it. This chemical may destroy living tissue on contact.
Physical properties of 1H-Pyrazole-3-methanamine,4-bromo-1-methyl-: (1)ACD/LogP: -0.50; (2)ACD/BCF (pH 5.5): 1; (3)ACD/BCF (pH 7.4): 1; (4)ACD/KOC (pH 5.5): 1; (5)ACD/KOC (pH 7.4): 14; (6)#H bond acceptors: 3; (7)#H bond donors: 2; (8)#Freely Rotating Bonds: 2; (9)Index of Refraction: 1.647; (10)Molar Refractivity: 39.331 cm3; (11)Molar Volume: 108.234 cm3; (12)Surface Tension: 51.302 dyne/cm; (13)Density: 1.756 g/cm3; (14)Flash Point: 126.085 °C; (15)Enthalpy of Vaporization: 52.388 kJ/mol; (16)Boiling Point: 284.87 °C at 760 mmHg; (17)Vapour Pressure: 0.003 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: NCc1nn(C)cc1Br
(2)InChI: InChI=1/C5H8BrN3/c1-9-3-4(6)5(2-7)8-9/h3H,2,7H2,1H3
(3)InChIKey: MQRWZRWVHPJPON-UHFFFAOYAA