Ethyl 1H-1,2,3-triazole-4-carboxylate

Catalog Number

ACM40594987

Product Name

Ethyl 1H-1,2,3-triazole-4-carboxylate

Structure

CAS

40594-98-7

Category

Heterocyclic Organic Compound

Synonyms

ethyl 1H-1,2,3-triazole-4-carboxylate;40594-98-7;ethyl 2H-1,2,3-triazole-4-carboxylate;ethyl 1H-1,2,3-triazole-5-carboxylate;1084802-21-0;1H-1,2,3-Triazole-4-carboxylic acid, ethyl ester;ethyl 2H-triazole-4-carboxylate;ethyl 1,2,3-triazole-4-carboxylate;MFCD08669518;1H-1,2,3-triazole-4-carboxylic acid ethyl ester;1H-1,2,3-Triazole-4-carboxylic acid, 1-(4-chlorophenyl)-5-[(triphenylphosphoranylidene)amino]-, ethyl ester;SCHEMBL561752;2H-1,2,3-Triazole-4-carboxylic acid, ethyl ester;ethyl 1H-triazole-4-carboxylate;DTXSID30423546;5-ethoxycarbonyl-1,2,3-triazole;ANW-66281;MFCD27959308;ZINC33943379;4-ethoxycarbonyl-2h-1,2,3-triazole;AKOS007930815;AKOS027404018;NE61027;Quinoline-5-carboxylic acid ethyl ester;AK-76943;AM803858;DA-26188;DS-16918;QC-11328;SY111481;AB0055877;DB-023512;CS-0037024;FT-0653257;FT-0768744;Z4712;Q-9306;594T987;Z1741980865

IUPAC Name

ethyl 2H-triazole-4-carboxylate

Molecular Weight

141.13g/mol

Molecular Formula

C5H7N3O2

Canonical SMILES

CCOC(=O)C1=NNN=C1

InChI

InChI=1S/C5H7N3O2/c1-2-10-5(9)4-3-6-8-7-4/h3H,2H2,1H3,(H,6,7,8)

InChI Key

BMGCDMZWMQQHMI-UHFFFAOYSA-N

Complexity

128

Covalently-Bonded Unit Count

1

Exact Mass

141.053826475g/mol

Heavy Atom Count

10

Hydrogen Bond Acceptor Count

4

Monoisotopic Mass

141.053826475g/mol

Rotatable Bond Count

3

Topological Polar Surface Area

67.9Ų

XLogP3

0.1

MSDS

COA

Spec Sheet