Name: Name:1-methyl-5-(trifluoromethyl)-1H-pyrazole-4-sulfonyl chloride
Brand: Angene
SKU: AG01BRIM
Rating: 90 (10 reviews)

1-methyl-5-(trifluoromethyl)-1H-pyrazole-4-sulfonyl chloride

CAS No.:

1365939-85-0

Catalog Number:

AG01BRIM

Molecular Formula:

C5H4ClF3N2O2S

Molecular Weight:

248.6107

Catalog Number:

AG01BRIM

Chemical Name:

1-methyl-5-(trifluoromethyl)-1H-pyrazole-4-sulfonyl chloride

CAS Number:

1365939-85-0

Molecular Formula:

C5H4ClF3N2O2S

Molecular Weight:

248.6107

MDL Number:

MFCD21647234

IUPAC Name:

1-methyl-5-(trifluoromethyl)pyrazole-4-sulfonyl chloride

InChI:

InChI=1S/C5H4ClF3N2O2S/c1-11-4(5(7,8)9)3(2-10-11)14(6,12)13/h2H,1H3

InChI Key:

WYLMQTQGNXQZHD-UHFFFAOYSA-N

SMILES:

Cn1ncc(c1C(F)(F)F)S(=O)(=O)Cl

Complexity:

312

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:

1.2