Name: Name:1,3-dimethyl-5-(2,2,2-trifluoroethoxy)-1H-pyrazole-4-carbaldehyde
Brand: Angene
SKU: AG01A8ZM
Rating: 90 (10 reviews)

1,3-dimethyl-5-(2,2,2-trifluoroethoxy)-1H-pyrazole-4-carbaldehyde

CAS No.:

126764-32-7

Catalog Number:

AG01A8ZM

Molecular Formula:

C8H9F3N2O2

Molecular Weight:

222.1645

Catalog Number:

AG01A8ZM

Chemical Name:

1,3-dimethyl-5-(2,2,2-trifluoroethoxy)-1H-pyrazole-4-carbaldehyde

CAS Number:

126764-32-7

Molecular Formula:

C8H9F3N2O2

Molecular Weight:

222.1645

MDL Number:

MFCD11191307

IUPAC Name:

1,3-dimethyl-5-(2,2,2-trifluoroethoxy)pyrazole-4-carbaldehyde

InChI:

InChI=1S/C8H9F3N2O2/c1-5-6(3-14)7(13(2)12-5)15-4-8(9,10)11/h3H,4H2,1-2H3

InChI Key:

IDUSRUSDBWEITC-UHFFFAOYSA-N

SMILES:

O=Cc1c(C)nn(c1OCC(F)(F)F)C

Complexity:

234

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

222.062g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

222.167g/mol

Monoisotopic Mass:

222.062g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

44.1A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

1.5