Name: Name:1-(2,2,2-trifluoroethyl)pyrazole-4-sulfonyl chloride
Brand: Angene
SKU: AG019C9H
Rating: 90 (10 reviews)

1-(2,2,2-trifluoroethyl)pyrazole-4-sulfonyl chloride

CAS No.:

1006487-19-9

Catalog Number:

AG019C9H

Molecular Formula:

C5H4ClF3N2O2S

Molecular Weight:

248.6107

Catalog Number:

AG019C9H

Chemical Name:

1-(2,2,2-trifluoroethyl)pyrazole-4-sulfonyl chloride

CAS Number:

1006487-19-9

Molecular Formula:

C5H4ClF3N2O2S

Molecular Weight:

248.6107

MDL Number:

MFCD08696567

IUPAC Name:

1-(2,2,2-trifluoroethyl)pyrazole-4-sulfonyl chloride

InChI:

InChI=1S/C5H4ClF3N2O2S/c6-14(12,13)4-1-10-11(2-4)3-5(7,8)9/h1-2H,3H2

InChI Key:

APYOSJHRHDKPEH-UHFFFAOYSA-N

SMILES:

FC(Cn1ncc(c1)S(=O)(=O)Cl)(F)F

Complexity:

299

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

247.963g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

248.604g/mol

Monoisotopic Mass:

247.963g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

60.3A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

1.3