Basic information
- CAS
60178-91-8- Standard SMILES
CCOC(=O)C1=NN(C)C(=O)C1- InChIKey
DQFLWSBMPHOKEP-UHFFFAOYSA-N- Molecular formula
- C7H10N2O3
- Average molar mass
- 170.17 g/mol
- Monoisotopic mass
- 170.06914219
Names & identifiers
- Preferred name
- ethyl 1-methyl-5-oxo-4H-pyrazole-3-carboxylate
- IUPAC
- ethyl 1-methyl-5-oxo-4H-pyrazole-3-carboxylate
- English name
- ethyl 1-methyl-5-oxo-4H-pyrazole-3-carboxylate
- Molecular formula
- C7H10N2O3
- Molecular weight
- 170.17
Names & synonyms
ethyl 1-methyl-5-oxo-4H-pyrazole-3-carboxylate60178-91-8NSC278750Ethyl 1-methyl-5-oxo-4,5-dihydro-1H-pyrazole-3-carboxylateSCHEMBL15690127DTXSID50313935NSC-278750DB-3078961H-Pyrazole-3-carboxylic acid, 4,5-dihydro-1-methyl-5-oxo-, ethyl ester
Database identifiers
- CAS
60178-91-8- PubChem CID
- 322256
- DTXSID
DTXSID50313935- Nikkaji
- J355.047H
Properties
Computed structural properties
- XLogP
- 0
- Topological polar surface area
- 59 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 3
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 247
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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