CAS No.34972-22-0,2-AMINO-3-METHYLQUINOXALINE Suppliers

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Basic Information

Molecular Structure:
CAS No.:	34972-22-0
Name:	2-AMINO-3-METHYLQUINOXALINE

Formula:	C₉H₉N₃
Molecular Weight:	159.191
Synonyms:	NSC 612233;3-Methyl-2-quinoxalinamine;2-Amino-3-methylquinoxaline;Quinoxaline,2-amino-3-methyl- (6CI);
Density:	1.238g/cm³
Boiling Point:	294.2 °C at 760 mmHg
Flash Point:	156.8 °C
PSA:	51.80000
LogP:	2.10160

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Specification

The 2-Quinoxalinamine,3-methyl-, with CAS registry number 34972-22-0, belongs to the following product category: API intermediates. It has the systematic name of 3-methylquinoxalin-2-amine. And the chemical formula of this chemical is C₉H₉N₃.

Physical properties of 2-Quinoxalinamine,3-methyl-: (1)ACD/LogP: 2.10; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 2.08; (4)ACD/LogD (pH 7.4): 2.1; (5)ACD/BCF (pH 5.5): 22.19; (6)ACD/BCF (pH 7.4): 23.1; (7)ACD/KOC (pH 5.5): 316.31; (8)ACD/KOC (pH 7.4): 329.32; (9)#H bond acceptors: 3; (10)#H bond donors: 2; (11)#Freely Rotating Bonds: 0; (12)Polar Surface Area: 29.02 Å²; (13)Index of Refraction: 1.693; (14)Molar Refractivity: 49.33 cm³; (15)Molar Volume: 128.5 cm³; (16)Polarizability: 19.55×10^-24cm³; (17)Surface Tension: 63.4 dyne/cm; (18)Density: 1.238 g/cm³; (19)Flash Point: 156.8 °C; (20)Enthalpy of Vaporization: 53.38 kJ/mol; (21)Boiling Point: 294.2 °C at 760 mmHg; (22)Vapour Pressure: 0.00165 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: n1c2ccccc2nc(c1C)N
(2)InChI: InChI=1/C9H9N3/c1-6-9(10)12-8-5-3-2-4-7(8)11-6/h2-5H,1H3,(H2,10,12)
(3)InChIKey: WGHZDFAULZNZJE-UHFFFAOYAA
(4)Std. InChI: InChI=1S/C9H9N3/c1-6-9(10)12-8-5-3-2-4-7(8)11-6/h2-5H,1H3,(H2,10,12)
(5)Std. InChIKey: WGHZDFAULZNZJE-UHFFFAOYSA-N