Ethyl 2-(5-Cyclopropyl-3-(trifluoromethyl)-1H-pyrazol-1-yl)acetate

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Basic information

CAS: 1002033-66-0
Standard SMILES: CCOC(=O)Cn1nc(C(F)(F)F)cc1C1CC1
InChIKey: OTBNUUMXSXCSSY-UHFFFAOYSA-N
Molecular formula: C11H13F3N2O2
Average molar mass: 262.23 g/mol
Monoisotopic mass: 262.09291215

Names & identifiers

Preferred name: Ethyl 2-(5-Cyclopropyl-3-(trifluoromethyl)-1H-pyrazol-1-yl)acetate
IUPAC: ethyl 2-[5-cyclopropyl-3-(trifluoromethyl)pyrazol-1-yl]acetate
English name: ethyl [5-cyclopropyl-3-(trifluoromethyl)-1H-pyrazol-1-yl]acetate
Molecular formula: C11H13F3N2O2
Molecular weight: 262.23

Names & synonyms

1002033-66-0Ethyl 2-(5-Cyclopropyl-3-(trifluoromethyl)-1H-pyrazol-1-yl)acetateethyl 2-[5-cyclopropyl-3-(trifluoromethyl)pyrazol-1-yl]acetateethyl [5-cyclopropyl-3-(trifluoromethyl)-1H-pyrazol-1-yl]acetateethyl 2-[5-cyclopropyl-3-(trifluoromethyl)-1H-pyrazol-1-yl]acetate(5-Cyclopropyl-3-trifluoromethyl-pyrazol-1-yl)-acetic acid ethyl esterMFCD04967317SCHEMBL23213616DTXSID101180721SBB021305STK313004AKOS000305880

Show more names

1H-Pyrazole-1-acetic acid, 5-cyclopropyl-3-(trifluoromethyl)-, ethyl ester

ST106554CS-0299138EN300-229021ethyl 2-[5-cyclopropyl-3-(trifluoromethyl)pyrazolyl]acetateEthyl 5-cyclopropyl-3-(trifluoromethyl)-1H-pyrazole-1-acetateEthyl2-(5-Cyclopropyl-3-(trifluoromethyl)-1H-pyrazol-1-yl)acetate

Database identifiers

CAS: 1002033-66-0
PubChem CID: 7017154
DTXSID: DTXSID101180721

Properties

Computed structural properties

XLogP: 2.1
Topological polar surface area: 44.1 Å²
Hydrogen bond donors: 0
Hydrogen bond acceptors: 6
Rotatable bonds: 5
Heavy atoms: 18
Formal charge: 0
Complexity: 318

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Compound notes

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