Molecular Structure of Methyl (2-amino-5-methyl-1,3-thiazol-4-yl)acetate (CAS No.72054-60-5):
Molecular Formula: C7H10N2O2S
Molecular Weight: 186.2315
CAS No: 72054-60-5
H bond acceptors: 4
H bond donors: 2
Freely Rotating Bonds: 3
Polar Surface Area: 70.67 Å2
Index of Refraction: 1.579
Molar Refractivity: 47.74 cm3
Molar Volume: 143.4 cm3
Surface Tension: 54 dyne/cm
Density: 1.297 g/cm3
Flash Point: 149.9 °C
Enthalpy of Vaporization: 56.62 kJ/mol
Boiling Point: 324.2 °C at 760 mmHg
Vapour Pressure: 0.00025 mmHg at 25°C
InChI: InChI=1/C7H10N2O2S/c1-4-5(3-6(10)11-2)9-7(8)12-4/h3H2,1-2H3,(H2,8,9)
InChIKey: LJTGLNPZNUZMIZ-UHFFFAOYAD
Std. InChI: InChI=1S/C7H10N2O2S/c1-4-5(3-6(10)11-2)9-7(8)12-4/h3H2,1-2H3,(H2,8,9)
Std. InChIKey: LJTGLNPZNUZMIZ-UHFFFAOYSA-N