Molecular structure of Ethyl 1H-1,2,3-triazole-5-carboxylate (CAS NO.40594-98-7) is:
Product Name: Ethyl 1H-1,2,3-triazole-5-carboxylate
CAS Registry Number: 40594-98-7
Systematic Name: ethyl 2H-1,2,3-triazole-4-carboxylate
Molecular Formula: C5H7N3O2
Molecular Weight: 141.13
Index of Refraction: 1.524
Molar Refractivity: 33.27 cm3
Molar Volume: 108.6 cm3
Surface Tension: 58 dyne/cm
Density: 1.299 g/cm3
Flash Point: 126 °C
Enthalpy of Vaporization: 52.37 kJ/mol
Boiling Point: 284.7 °C at 760 mmHg
Vapour Pressure: 0.00293 mmHg at 25 °C
Product Categories: CARBOXYLICESTER
SMILES: O=C(OCC)c1nnnc1
InChI: InChI=1/C5H7N3O2/c1-2-10-5(9)4-3-6-8-7-4/h3H,2H2,1H3,(H,6,7,8)
InChIKey: BMGCDMZWMQQHMI-UHFFFAOYAP
Std. InChI: InChI=1S/C5H7N3O2/c1-2-10-5(9)4-3-6-8-7-4/h3H,2H2,1H3,(H,6,7,8)
Std. InChIKey: BMGCDMZWMQQHMI-UHFFFAOYSA-N
Ethyl 1H-1,2,3-triazole-5-carboxylate , its cas register number is 40594-98-7. It also can be called 3H-[1,2,3]Triazole-4-carboxylic acid ethyl ester ; 1H-1,2,3-Triazole-5-carboxylicacid, ethyl ester .
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