CAS No.13425-92-8,4-AMINO-6,7-DIMETHOXYQUINOLINE Suppliers

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Basic Information

Molecular Structure:
CAS No.:	13425-92-8
Name:	4-AMINO-6,7-DIMETHOXYQUINOLINE
Article Data:	3

Formula:	C₁₁H₁₂N₂O₂
Molecular Weight:	204.228
Synonyms:	Quinoline,4-amino-6,7-dimethoxy- (8CI);4-Amino-6,7-dimethoxyquinoline;Amiquinsin;
Density:	1.222 g/cm³
Boiling Point:	387.4 °C at 760 mmHg
Flash Point:	188.1 °C
PSA:	57.37000
LogP:	2.41540

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Specification

The IUPAC name of 6,7-Dimethoxyquinolin-4-amine is 6,7-dimethoxyquinolin-4-amine. With the CAS registry number 13425-92-8, it is also named as Amiquinsin. In addition, its molecular formula is C₁₁H₁₂N₂O₂ and molecular weight is 204.23.

The other characteristics of 6,7-Dimethoxyquinolin-4-amine can be summarized as: (1)ACD/LogP: 1.88; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): -0.61; (4)ACD/LogD (pH 7.4): -0.03; (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): 3.07; (9)#H bond acceptors: 4; (10)#H bond donors: 2; (11)#Freely Rotating Bonds: 3; (12)Polar Surface Area: 34.59 Å²; (13)Index of Refraction: 1.634; (14)Molar Refractivity: 59.77 cm³; (15)Molar Volume: 167 cm³; (16)Polarizability: 23.69×10^-24cm³; (17)Surface Tension: 50 dyne/cm; (18)Density: 1.222 g/cm³; (19)Flash Point: 188.1 °C; (20)Enthalpy of Vaporization: 63.64 kJ/mol; (21)Boiling Point: 387.4 °C at 760 mmHg; (22)Vapour Pressure: 3.31E-06 mmHg at 25 °C.

People can use the following data to convert to the molecule structure.
(1)SMILES: O(c1cc2nccc(c2cc1OC)N)C
(2)InChI: InChI=1/C11H12N2O2/c1-14-10-5-7-8(12)3-4-13-9(7)6-11(10)15-2/h3-6H,1-2H3,(H2,12,13)
(3)InChIKey: UZVYGOXJMRZJFK-UHFFFAOYAN
(4)Std. InChI: InChI=1S/C11H12N2O2/c1-14-10-5-7-8(12)3-4-13-9(7)6-11(10)15-2/h3-6H,1-2H3,(H2,12,13)
(5)Std. InChIKey: UZVYGOXJMRZJFK-UHFFFAOYSA-N