chempirical

Ethyl 3-amino-1H-pyrazole-4-carboxylate

C6H9N3O2CAS 6994-25-8155.16 g/mol

Open in Covalent MOL file
OONHNHHN
Ester

Properties

Molecular formula
C6H9N3O2
Molar mass
155.16 g/mol
Exact mass
155.0695 Da
Melting point
102–103 °C
logP
0.00Crippen estimate
Polar surface area
81.7 Ų
H-bond donors / acceptors
3 / 3
Rotatable bonds
2

Identifiers

CAS number
6994-25-8
SMILES
CCOC(=O)c1c[nH][nH]c1=N
InChIKey
YPXGHKWOJXQLQU-UHFFFAOYSA-N
InChI
InChI=1S/C6H9N3O2/c1-2-11-6(10)4-3-8-9-5(4)7/h3H,2H2,1H3,(H3,7,8,9)

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Names and synonyms

13 names · show all
  • 1H-Pyrazole-4-carboxylic acid, 3-amino-, ethyl ester
  • Pyrazole-4-carboxylic acid, 3-amino-, ethyl ester
  • Pyrazole-4-carboxylic acid, 3(or 5)-amino-, ethyl ester
  • 3-Amino-4-carbethoxypyrazole
  • Ethyl 3-aminopyrazole-4-carboxylate
  • 3-Amino-4-(ethoxycarbonyl)pyrazole
  • Ethyl 5-amino-4-pyrazolecarboxylate
  • Ethyl 5-aminopyrazol-4-carboxylate
  • Ethyl 3-aminopyrazol-4-carboxylate
  • 3-Amino-1H-pyrazole-4-carboxylic acid ethyl ester
  • Ethyl 5-amino-1H-pyrazole-4-carboxylate
  • NSC 521580
  • 3-Amino-4-carboethoxy-2H-pyrazole

Work with Ethyl 3-amino-1H-pyrazole-4-carboxylate

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Similar compounds

Ethyl 6-amino-1,2-dihydro-2-thioxo-5-pyrimidinecarboxylate774-07-251 % similar 4-Amino-2-methanethiopyrimidine-5-carboxylic acid ethyl ester776-53-450 % similar Diethyl phthalate84-66-250 % similar Ethyl 2-amino-1,4-dihydro-4-oxo-5-pyrimidinecarboxylate15400-53-048 % similar Ethyl 3-methylpyrazole-4-carboxylate85290-78-448 % similar 3-Amino-1H-pyrazole-4-carboxylic acid41680-34-647 % similar Ethyl 1H-pyrazole-4-carboxylate37622-90-546 % similar Diethyl 2,5-dihydroxyterephthalate5870-38-246 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Same formula

Ethyl 5-amino-1H-pyrazole-3-carboxylate105434-90-0 Cupferron135-20-6 2-Amino-4,6-dimethoxypyrimidine256642-28-1 2,6-Dimethoxy-4-pyrimidinamine3289-50-7 D-Histidine351-50-8 2-Amino-4,6-dimethoxypyrimidine36315-01-2 Dl-histidine4998-57-6 4-Amino-5,6-dimethoxypyrimidine5018-45-1

Elsewhere

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