Name: Name:ETHYL 1-(TERT-BUTYL)-5-(TRIFLUOROMETHYL)-1H-PYRAZOLE-4-CARBOXYLATE
Brand: Angene
SKU: AG00G7L7
Rating: 90 (10 reviews)

ETHYL 1-(TERT-BUTYL)-5-(TRIFLUOROMETHYL)-1H-PYRAZOLE-4-CARBOXYLATE

CAS No.:

852691-03-3

Catalog Number:

AG00G7L7

Molecular Formula:

C11H15F3N2O2

Molecular Weight:

264.2442

Catalog Number:

AG00G7L7

Chemical Name:

ETHYL 1-(TERT-BUTYL)-5-(TRIFLUOROMETHYL)-1H-PYRAZOLE-4-CARBOXYLATE

CAS Number:

852691-03-3

Molecular Formula:

C11H15F3N2O2

Molecular Weight:

264.2442

MDL Number:

MFCD04973716

IUPAC Name:

ethyl 1-tert-butyl-5-(trifluoromethyl)pyrazole-4-carboxylate

InChI:

InChI=1S/C11H15F3N2O2/c1-5-18-9(17)7-6-15-16(10(2,3)4)8(7)11(12,13)14/h6H,5H2,1-4H3

InChI Key:

SBLLZGMBYZIVGM-UHFFFAOYSA-N

SMILES:

CCOC(=O)c1cnn(c1C(F)(F)F)C(C)(C)C

Complexity:

312

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

264.109g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

264.248g/mol

Monoisotopic Mass:

264.109g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

44.1A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

2.3