Ethyl 3-indazolecarboxylate

C10H10N2O2CAS 4498-68-4190.20 g/mol

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OONNH
Ester

Properties

Molecular formula
C10H10N2O2
Molar mass
190.20 g/mol
Exact mass
190.0742 Da
Melting point
136–137 °C
logP
1.74Crippen estimate
Polar surface area
55.0 Ų
H-bond donors / acceptors
1 / 3
Rotatable bonds
2

Hazards

No GHS classification is on file for this compound. That is not evidence that it is harmless.

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Identifiers

CAS number
4498-68-4
SMILES
CCOC(=O)c1n[nH]c2ccccc12
InChIKey
YLKPTYMNELPKOL-UHFFFAOYSA-N
InChI
InChI=1S/C10H10N2O2/c1-2-14-10(13)9-7-5-3-4-6-8(7)11-12-9/h3-6H,2H2,1H3,(H,11,12)

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Names and synonyms

4 names
  • 1H-Indazole-3-carboxylic acid, ethyl ester
  • NSC 179807
  • 3-Ethoxycarbonylindazole
  • Ethyl 1H-indazole-3-carboxylate

Reactions

Work with Ethyl 3-indazolecarboxylate

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Similar compounds

Methyl 1H-indazole-3-carboxylate43120-28-167 % similar Ethyl indole-3-carboxylate776-41-056 % similar Ethyl 3-bromoindole-2-carboxylate91348-45-752 % similar Indazole-3-carboxylic acid4498-67-351 % similar 4-Hydroxyquinoline-3-carboxylic acid ethyl ester26892-90-051 % similar Diethyl phthalate84-66-250 % similar Ethyl 1H-indole-2-carboxylate3770-50-149 % similar Ethyl 1-naphthalenecarboxylate3007-97-449 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

Methyl 4-amino-6-indolecarboxylate121561-15-7 3-Benzoimidazol-1-yl-propionic acid14840-18-7 Ethyl pyrazolo(1,5-a)pyridine-3-carboxylate16205-44-0 L-4-Cyanophenylalanine167479-78-9 Ethyl 1H-pyrrolo(3,2-b)pyridine-2-carboxylate17288-32-3 1H-Benzoimidazole-2-carboxylic acid ethyl ester1865-09-4 2,3-Dimethyl-5-nitro-1H-indole21296-94-6 1H-Benzimidazole-2-propanoic acid23249-97-0

Elsewhere

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