methyl 5-chloro-1-methyl-3-(trifluoromethyl)-1H-pyrazole-4-carboxylate

HCID 1473689

Basic information

Standard SMILES
COC(=O)c1c(C(F)(F)F)nn(C)c1Cl
InChIKey
NYUZQKQIFYNNNQ-UHFFFAOYSA-N
Molecular formula
C7H6ClF3N2O2
Average molar mass
242.58 g/mol

Names & identifiers

Preferred name
methyl 5-chloro-1-methyl-3-(trifluoromethyl)-1H-pyrazole-4-carboxylate
IUPAC
methyl 5-chloro-1-methyl-3-(trifluoromethyl)pyrazole-4-carboxylate

Names & synonyms

methyl 5-chloro-1-methyl-3-(trifluoromethyl)-1H-pyrazole-4-carboxylate219568-13-5MFCD04125040methyl 5-chloro-1-methyl-3-(trifluoromethyl)pyrazole-4-carboxylateSCHEMBL841191AKOS0159925183F-368SCS-0361892methyl5-chloro-1-methyl-3-(trifluoromethyl)-1H-pyrazole-4-carboxylate

Database identifiers

PubChem CID
1473689

Properties

Computed structural properties

XLogP
2
Topological polar surface area
44.1 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
6
Rotatable bonds
2
Heavy atoms
15

Related reactions

3 records

Compound notes

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