Name: Name:3-amino-1-(2,2,2-trifluoroethyl)-1H-pyrazole-4-carbonitrile
Brand: Angene
SKU: AG01EJSL
Rating: 90 (10 reviews)

3-amino-1-(2,2,2-trifluoroethyl)-1H-pyrazole-4-carbonitrile

CAS No.:

1935013-05-0

Catalog Number:

AG01EJSL

Molecular Formula:

C6H5F3N4

Molecular Weight:

190.1259

Catalog Number:

AG01EJSL

Chemical Name:

3-amino-1-(2,2,2-trifluoroethyl)-1H-pyrazole-4-carbonitrile

CAS Number:

1935013-05-0

Molecular Formula:

C6H5F3N4

Molecular Weight:

190.1259

MDL Number:

MFCD31668003

IUPAC Name:

3-amino-1-(2,2,2-trifluoroethyl)pyrazole-4-carbonitrile

InChI:

InChI=1S/C6H5F3N4/c7-6(8,9)3-13-2-4(1-10)5(11)12-13/h2H,3H2,(H2,11,12)

InChI Key:

GSQPJSNVVLQYME-UHFFFAOYSA-N

SMILES:

N#Cc1cn(nc1N)CC(F)(F)F

Complexity:

230

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

190.047g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

190.129g/mol

Monoisotopic Mass:

190.047g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

67.6A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

1.2