Basic information
- Standard SMILES
CCOC(=O)c1n[nH]c(C)c1Cl- InChIKey
YEUFDJAHBFUZMI-UHFFFAOYSA-N- Molecular formula
- C7H9ClN2O2
- Average molar mass
- 188.61 g/mol
Names & identifiers
- Preferred name
- ethyl 4-chloro-5-methyl-1H-pyrazole-3-carboxylate
- IUPAC
- ethyl 4-chloro-5-methyl-1H-pyrazole-3-carboxylate
Names & synonyms
ethyl 4-chloro-5-methyl-1H-pyrazole-3-carboxylate637022-63-0Ethyl 4-chloro-5-methylpyrazole-3-carboxylateSCHEMBL2846088SCHEMBL28741554-Chloro-5-methyl-1H-pyrazole-3-carboxylic acid ethyl esterAKOS024015213DB-091513F97767Ethyl 4-chloro-3-methyl-1H-pyrazole-5-carboxylate #4-Chloro-5-methylpyrazole-3-carboxylic Acid Ethyl Ester4-Chloro-3-methyl-1H-pyrazole-5-carboxylic acid ethyl ester
Show more names
4-Chloro-5-methyl-2H-pyrazole-3-carboxylic acid ethyl ester
Database identifiers
- PubChem CID
- 604759
Properties
Computed structural properties
- XLogP
- 1.8
- Topological polar surface area
- 55 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 177
Related reactions
16 records
Linked notes
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