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CAS No.: | 99071-54-2 |
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Name: | 6-Aminomethylquinoline |
Article Data: | 17 |
Molecular Structure: | |
Formula: | C10H10N2 |
Molecular Weight: | 158.203 |
Synonyms: | Quinoline,6-(aminomethyl)- (6CI);(Quinolin-6-ylmethyl)amine;6-(Aminomethyl)quinoline;Quinolin-6-ylmethanamine; |
Density: | 1.156 g/cm3 |
Boiling Point: | 314.7 °C at 760 mmHg |
Flash Point: | 169.9 °C |
PSA: | 38.91000 |
LogP: | 2.39380 |
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This chemical is called 6-Quinolinemethanamine, and its IUPAC name is quinolin-6-ylmethanamine. With the molecular formula of C10H10N2, its molecular weight is 158.20. The CAS registry number of this chemical is 99071-54-2. Additionally, its product categories are Amines and Anilines; Heterocycles; Pharmacetical; Quinoline.
Other characteristics of the 6-Quinolinemethanamine can be summarised as followings: (1)ACD/LogP: 0.96; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): -2.05; (4)ACD/LogD (pH 7.4): -0.75; (5)ACD/BCF (pH 5.5): 1; (6)ACD/BCF (pH 7.4): 1; (7)ACD/KOC (pH 5.5): 1; (8)ACD/KOC (pH 7.4): 1.57; (9)#H bond acceptors: 2; (10)#H bond donors: 2; (11)#Freely Rotating Bonds: 2; (12)Polar Surface Area: 16.13 Å2; (13)Index of Refraction: 1.662; (14)Molar Refractivity: 50.63 cm3; (15)Molar Volume: 136.7 cm3; (16)Polarizability: 20.07×10-24cm3; (17)Surface Tension: 54.2 dyne/cm; (18)Density: 1.156 g/cm3; (19)Flash Point: 169.9 °C; (20)Enthalpy of Vaporization: 55.59 kJ/mol; (21)Boiling Point: 314.7 °C at 760 mmHg; (22)Vapour Pressure: 0.000458 mmHg at 25°C.
You can still convert the following datas into molecular structure:
1.SMILES: n1cccc2cc(ccc12)CN
2.InChI: InChI=1/C10H10N2/c11-7-8-3-4-10-9(6-8)2-1-5-12-10/h1-6H,7,11H2
3.InChIKey: RZIPENSSTUBRAA-UHFFFAOYAA