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CAS No.: | 912569-66-5 |
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Name: | N-Methyl-3-[(6-methylpyrazin-2-yl)oxy]benzylamine |
Molecular Structure: | |
Formula: | C13H15N3O |
Molecular Weight: | 229.2777 |
Synonyms: | Benzenemethanamine,N-methyl-3-[(6-methylpyrazinyl)oxy]- (9CI); |
Density: | 1.121g/cm3 |
Boiling Point: | 346.4 °C at 760 mmHg |
Flash Point: | 163.3 °C |
Hazard Symbols: | C |
PSA: | 47.04000 |
LogP: | 2.68760 |
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The Benzenemethanamine,N-methyl-3-[(6-methyl-2-pyrazinyl)oxy]-, with CAS registry number 912569-66-5, has the systematic name of N-methyl-1-[3-(6-methylpyrazin-2-yl)oxyphenyl]methanamine. Besides this, it is also called N-Methyl-3-[(6-methylpyrazin-2-yl)oxy]benzylamine. This chemical may destroy living tissue on contact. And the chemical formula of this chemical is C13H15N3O.
Physical properties of Benzenemethanamine,N-methyl-3-[(6-methyl-2-pyrazinyl)oxy]-: (1)ACD/LogP: 1.14; (2)# of Rule of 5 Violations: 0; (3)#H bond acceptors: 4; (4)#H bond donors: 1; (5)#Freely Rotating Bonds: 4; (6)Polar Surface Area: 47.04 Å2; (7)Index of Refraction: 1.567; (8)Molar Refractivity: 66.84 cm3; (9)Molar Volume: 204.3 cm3; (10)Polarizability: 26.5×10-24cm3; (11)Surface Tension: 44.8 dyne/cm; (12)Density: 1.121 g/cm3; (13)Flash Point: 163.3 °C; (14)Enthalpy of Vaporization: 59.06 kJ/mol; (15)Boiling Point: 346.4 °C at 760 mmHg; (16)Vapour Pressure: 5.77E-05 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: Cc1cncc(n1)Oc2cccc(c2)CNC
(2)InChI: InChI=1/C13H15N3O/c1-10-7-15-9-13(16-10)17-12-5-3-4-11(6-12)8-14-2/h3-7,9,14H,8H2,1-2H3
(3)InChIKey: RCWJJFNDMQYPQK-UHFFFAOYAY
(4)Std. InChI: InChI=1S/C13H15N3O/c1-10-7-15-9-13(16-10)17-12-5-3-4-11(6-12)8-14-2/h3-7,9,14H,8H2,1-2H3
(5)Std. InChIKey: RCWJJFNDMQYPQK-UHFFFAOYSA-N