Name: Name:1-(1-ethyl-1H-pyrazol-4-yl)-2,2,2-trifluoroethan-1-one
Brand: Angene
SKU: AG01A2JN
Rating: 90 (10 reviews)

1-(1-ethyl-1H-pyrazol-4-yl)-2,2,2-trifluoroethan-1-one

CAS No.:

1174848-25-9

Catalog Number:

AG01A2JN

Molecular Formula:

C7H7F3N2O

Molecular Weight:

192.1385

Catalog Number:

AG01A2JN

Chemical Name:

1-(1-ethyl-1H-pyrazol-4-yl)-2,2,2-trifluoroethan-1-one

CAS Number:

1174848-25-9

Molecular Formula:

C7H7F3N2O

Molecular Weight:

192.1385

MDL Number:

MFCD10699048

IUPAC Name:

1-(1-ethylpyrazol-4-yl)-2,2,2-trifluoroethanone

InChI:

InChI=1S/C7H7F3N2O/c1-2-12-4-5(3-11-12)6(13)7(8,9)10/h3-4H,2H2,1H3

InChI Key:

GHCNDJSHSRZDCT-UHFFFAOYSA-N

SMILES:

CCn1ncc(c1)C(=O)C(F)(F)F

Complexity:

204

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

192.051g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

192.141g/mol

Monoisotopic Mass:

192.051g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

34.9A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

1.3