Name: Name:1,3,4-Thiadiazole, 2-(methylsulfonyl)-5-(trifluoromethyl)-
Brand: Angene
SKU: AG002U7Y
Rating: 90 (10 reviews)

1,3,4-Thiadiazole, 2-(methylsulfonyl)-5-(trifluoromethyl)-

CAS No.:

27603-25-4

Catalog Number:

AG002U7Y

Molecular Formula:

C4H3F3N2O2S2

Molecular Weight:

232.2040

Catalog Number:

AG002U7Y

Chemical Name:

1,3,4-Thiadiazole, 2-(methylsulfonyl)-5-(trifluoromethyl)-

CAS Number:

27603-25-4

Molecular Formula:

C4H3F3N2O2S2

Molecular Weight:

232.2040

MDL Number:

MFCD04092021

IUPAC Name:

2-methylsulfonyl-5-(trifluoromethyl)-1,3,4-thiadiazole

InChI:

InChI=1S/C4H3F3N2O2S2/c1-13(10,11)3-9-8-2(12-3)4(5,6)7/h1H3

InChI Key:

SQLPTSMJAQPVKR-UHFFFAOYSA-N

SMILES:

FC(c1nnc(s1)S(=O)(=O)C)(F)F

EC Number:

809-978-0

Complexity:

283

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

231.959g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

232.195g/mol

Monoisotopic Mass:

231.959g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

96.5A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

0.9