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CAS No.: | 103041-34-5 |
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Name: | 3-5,6,7,8-tetrahydroquinolylmethylamine hydrochloride |
Molecular Structure: | |
Formula: | C10H14N2 |
Molecular Weight: | 162.235 |
Synonyms: | Quinoline,3-(aminomethyl)-5,6,7,8-tetrahydro- (6CI);1-(5,6,7,8-Tetrahydroquinolin-3-yl)methanamine; |
Density: | 1.085 g/cm3 |
Boiling Point: | 301.985 °C at 760 mmHg |
Flash Point: | 157.077 °C |
PSA: | 38.91000 |
LogP: | 2.11940 |
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The 3-Quinolinemethanamine,5,6,7,8-tetrahydro-, with the CAS registry number 103041-34-5, is also known as Quinoline,3-(aminomethyl)-5,6,7,8-tetrahydro- (6CI). This chemical's molecular formula is C10H14N2 and molecular weight is 162.235. What's more, its systematic name is 5,6,7,8-Tetrahydroquinolin-3-ylmethanamine.
Physical properties about 3-Quinolinemethanamine,5,6,7,8-tetrahydro-: (1)ACD/LogP: 1.20; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 7.4): 0.049; (4)ACD/BCF (pH 5.5): 1; (5)ACD/BCF (pH 7.4): 1; (6)ACD/KOC (pH 5.5): 1; (7)ACD/KOC (pH 7.4): 7.561; (8)#H bond acceptors: 2; (9)#H bond donors: 2; (10)#Freely Rotating Bonds: 2; (11)Polar Surface Area: 38.91 Å2; (12)Index of Refraction: 1.578; (13)Molar Refractivity: 49.582 cm3; (14)Molar Volume: 149.474 cm3; (15)Surface Tension: 48.042 dyne/cm; (16)Density: 1.085 g/cm3; (17)Flash Point: 157.077 °C; (18)Enthalpy of Vaporization: 54.217 kJ/mol; (19)Boiling Point: 301.985 °C at 760 mmHg; (20)Vapour Pressure: 0.001 mmHg at 25 °C.
You can still convert the following datas into molecular structure:
(1) SMILES: c1c(cnc2c1CCCC2)CN
(2) InChI: InChI=1/C10H14N2/c11-6-8-5-9-3-1-2-4-10(9)12-7-8/h5,7H,1-4,6,11H2
(3) InChIKey: CCTMHSMYQLQWKL-UHFFFAOYAZ