Products Categories
CAS No.: | 1017785-26-0 |
---|---|
Name: | 4-(Aminomethyl)-1-(4-fluorophenyl)-1H-pyrazol-5-amine |
Molecular Structure: | |
Formula: | C10H11FN4 |
Molecular Weight: | 206.2195432 |
Synonyms: | 5-Amino-1-(4-fluorophenyl)-1H-pyrazole-4-methanamine; |
Density: | 1.388 g/cm3 |
Boiling Point: | 383.257 °C at 760 mmHg |
Flash Point: | 185.587 °C |
PSA: | 69.86000 |
LogP: | 2.33380 |
What can I do for you?
Get Best Price
The 4-(Aminomethyl)-1-(4-fluorophenyl)-1H-pyrazol-5-amine, with the CAS registry number 1017785-26-0, is also known as 5-Amino-1-(4-fluorophenyl)-1H-pyrazole-4-methanamine. This chemical's molecular formula is C10H11FN4 and molecular weight is 206.2195432. What's more, its systematic name is 4-(Aminomethyl)-2-(4-fluorophenyl)pyrazol-3-amine.
Physical properties about 4-(Aminomethyl)-1-(4-fluorophenyl)-1H-pyrazol-5-amine are: (1)# of Rule of 5 Violations: 0; (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): 1; (6)#H bond acceptors: 4; (7)#H bond donors: 4; (8)#Freely Rotating Bonds: 4; (9)Polar Surface Area: 69.86 Å2; (10)Index of Refraction: 1.651; (11)Molar Refractivity: 54.241 cm3; (12)Molar Volume: 148.53 cm3; (13)Polarizability: 21.503×10-24 cm3; (14)Surface Tension: 52.199 dyne/cm; (15)Density: 1.388 g/cm3; (16)Flash Point: 185.587 °C; (17)Enthalpy of Vaporization: 63.177 kJ/mol; (18)Boiling Point: 383.257 °C at 760 mmHg; (19)Vapour Pressure: 0 mmHg at 25 °C .
You can still convert the following datas into molecular structure:
(1) SMILES: c1cc(ccc1n2c(c(cn2)CN)N)F
(2) InChI: InChI=1/C10H11FN4/c11-8-1-3-9(4-2-8)15-10(13)7(5-12)6-14-15/h1-4,6H,5,12-13H2
(3) InChIKey: QBJZLWRZRBQILR-UHFFFAOYAN