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Ethyl 1H-1,2,3-triazole-5-carboxylate

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Name

Ethyl 1H-1,2,3-triazole-5-carboxylate

EINECS N/A
CAS No. 40594-98-7 Density 1.299g/cm3
PSA 67.87000 LogP -0.01860
Solubility N/A Melting Point 102-104 °C
Formula C5H7 N3 O2 Boiling Point 284.7°C at 760 mmHg
Molecular Weight 141.129 Flash Point 126°C
Transport Information N/A Appearance N/A
Safety Risk Codes N/A
Molecular Structure Molecular Structure of 40594-98-7 (Ethyl 1H-1,2,3-triazole-5-carboxylate) Hazard Symbols N/A
Synonyms

1H-1,2,3-Triazole-4-carboxylicacid, ethyl ester (9CI); v-Triazole-4-carboxylic acid, ethyl ester (6CI);4-Ethoxycarbonyl-1H-1,2,3-triazole; Ethyl 1,2,3-triazole-4-carboxylate; Ethyl1,2,3-triazole-5-carboxylate; Ethyl 1H-1,2,3-triazole-4-carboxylate

Article Data 1

Ethyl 1H-1,2,3-triazole-5-carboxylate Chemical Properties

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 Specification

 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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