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CAS No.: | 5446-90-2 |
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Name: | 6-hydrazinyl-5H-purin-2-amine |
Article Data: | 5 |
Molecular Structure: | |
Formula: | C5H7N7 |
Molecular Weight: | 165.16 |
Synonyms: | 6H-Purin-6-one, 2-amino-1,7-dihydro-, hydrazone (9CI);Purine, 2-amino-6-hydrazino- (6CI,8CI);2-Amino-6-hydrazino-9H-purine;NSC 17110; |
Density: | 1.826 g/cm3 |
Boiling Point: | 804.889 °C at 760 mmHg |
Flash Point: | 440.581 °C |
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6-Hydrazino-9H-purin-2-amine is an organic compound with the formula C5H7N7, and its systematic name is the same with the product name. With the CAS registry number 5446-90-2, it is also named as 2-Amino-6-hydrazino-9H-purine. In addition, the molecular weight is 165.16.
Physical properties of 6-Hydrazino-9H-purin-2-amine are: (1)ACD/LogP: 0.006; (2)# of Rule of 5 Violations: 1; (3)ACD/LogD (pH 5.5): -0.18; (4)ACD/LogD (pH 7.4): 0.00; (5)ACD/BCF (pH 5.5): 1.00; (6)ACD/BCF (pH 7.4): 1.00; (7)ACD/KOC (pH 5.5): 15.50; (8)ACD/KOC (pH 7.4): 23.83; (9)#H bond acceptors: 7; (10)#H bond donors: 6; (11)#Freely Rotating Bonds: 1; (12)Polar Surface Area: 118.53 Å2; (13)Index of Refraction: 2.011; (14)Molar Refractivity: 45.55 cm3; (15)Molar Volume: 90.45 cm3; (16)Polarizability: 18.058×10-24cm3; (17)Surface Tension: 171.09 dyne/cm; (18)Density: 1.826 g/cm3; (19)Flash Point: 440.581 °C; (20)Enthalpy of Vaporization: 117.022 kJ/mol; (21)Boiling Point: 804.889 °C at 760 mmHg; (22)Vapour Pressure: 0 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: n1c(c2c(nc1N)ncn2)NN
(2)Std. InChI: InChI=1S/C5H7N7/c6-5-10-3-2(8-1-9-3)4(11-5)12-7/h1H,7H2,(H4,6,8,9,10,11,12)
(3)Std. InChIKey: KNOLGURLPMQDCC-UHFFFAOYSA-N