Name: Name:2-[3,5-BIS(TRIFLUOROMETHYL)PHENYL]ETHANETHIOAMIDE
Brand: Angene
SKU: AG003G8Z
Rating: 90 (10 reviews)

2-[3,5-BIS(TRIFLUOROMETHYL)PHENYL]ETHANETHIOAMIDE

CAS No.:

691868-49-2

Catalog Number:

AG003G8Z

Molecular Formula:

C10H7F6NS

Molecular Weight:

287.2247

Catalog Number:

AG003G8Z

Chemical Name:

2-[3,5-BIS(TRIFLUOROMETHYL)PHENYL]ETHANETHIOAMIDE

CAS Number:

691868-49-2

Molecular Formula:

C10H7F6NS

Molecular Weight:

287.2247

MDL Number:

MFCD01313627

IUPAC Name:

2-[3,5-bis(trifluoromethyl)phenyl]ethanethioamide

InChI:

InChI=1S/C10H7F6NS/c11-9(12,13)6-1-5(3-8(17)18)2-7(4-6)10(14,15)16/h1-2,4H,3H2,(H2,17,18)

InChI Key:

BBRJGUROVZDJPY-UHFFFAOYSA-N

SMILES:

NC(=S)Cc1cc(cc(c1)C(F)(F)F)C(F)(F)F

Complexity:

289

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

287.02g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

287.223g/mol

Monoisotopic Mass:

287.02g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

58.1A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

3.1