Name: Name:5-[(2,2,2-trifluoroethyl)amino]-1,3,4-thiadiazole-2-thiol
Brand: Angene
SKU: AG01A7YL
Rating: 90 (10 reviews)

5-[(2,2,2-trifluoroethyl)amino]-1,3,4-thiadiazole-2-thiol

CAS No.:

156377-70-7

Catalog Number:

AG01A7YL

Molecular Formula:

C4H4F3N3S2

Molecular Weight:

215.2199

Catalog Number:

AG01A7YL

Chemical Name:

5-[(2,2,2-trifluoroethyl)amino]-1,3,4-thiadiazole-2-thiol

CAS Number:

156377-70-7

Molecular Formula:

C4H4F3N3S2

Molecular Weight:

215.2199

MDL Number:

MFCD11201170

IUPAC Name:

5-(2,2,2-trifluoroethylamino)-3H-1,3,4-thiadiazole-2-thione

InChI:

InChI=1S/C4H4F3N3S2/c5-4(6,7)1-8-2-9-10-3(11)12-2/h1H2,(H,8,9)(H,10,11)

InChI Key:

CCXVNUIBDLAADX-UHFFFAOYSA-N

SMILES:

FC(CNc1nnc(s1)S)(F)F

Complexity:

224

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

214.98g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

215.212g/mol

Monoisotopic Mass:

214.98g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

93.8A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

1.9