Name: Name:ethyl 1-[2-(trifluoromethyl)phenyl]-1H-pyrazole-3-carboxylate
Brand: Angene
SKU: AG01A68G
Rating: 90 (10 reviews)

ethyl 1-[2-(trifluoromethyl)phenyl]-1H-pyrazole-3-carboxylate

CAS No.:

1461708-18-8

Catalog Number:

AG01A68G

Molecular Formula:

C13H11F3N2O2

Molecular Weight:

284.2338

Catalog Number:

AG01A68G

Chemical Name:

ethyl 1-[2-(trifluoromethyl)phenyl]-1H-pyrazole-3-carboxylate

CAS Number:

1461708-18-8

Molecular Formula:

C13H11F3N2O2

Molecular Weight:

284.2338

MDL Number:

MFCD26407580

IUPAC Name:

ethyl 1-[2-(trifluoromethyl)phenyl]pyrazole-3-carboxylate

InChI:

InChI=1S/C13H11F3N2O2/c1-2-20-12(19)10-7-8-18(17-10)11-6-4-3-5-9(11)13(14,15)16/h3-8H,2H2,1H3

InChI Key:

SHCRSAIXZBCTEJ-UHFFFAOYSA-N

SMILES:

CCOC(=O)c1ccn(n1)c1ccccc1C(F)(F)F

Complexity:

349

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

284.077g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

284.238g/mol

Monoisotopic Mass:

284.077g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

44.1A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

3.3