Name: Name:Benzenemethanamine, α-methyl-4-[(trifluoromethyl)thio]-, hydrochloride (1:1), (αR)-
Brand: Angene
SKU: AG0021M5
Rating: 90 (10 reviews)

Benzenemethanamine, α-methyl-4-[(trifluoromethyl)thio]-, hydrochloride (1:1), (αR)-

CAS No.:

1800240-39-4

Catalog Number:

AG0021M5

Molecular Formula:

C9H11ClF3NS

Molecular Weight:

257.7035

Catalog Number:

AG0021M5

Chemical Name:

Benzenemethanamine, α-methyl-4-[(trifluoromethyl)thio]-, hydrochloride (1:1), (αR)-

CAS Number:

1800240-39-4

Molecular Formula:

C9H11ClF3NS

Molecular Weight:

257.7035

MDL Number:

MFCD24418250

IUPAC Name:

(1R)-1-[4-(trifluoromethylsulfanyl)phenyl]ethanamine;hydrochloride

InChI:

InChI=1S/C9H10F3NS.ClH/c1-6(13)7-2-4-8(5-3-7)14-9(10,11)12;/h2-6H,13H2,1H3;1H/t6-;/m1./s1

InChI Key:

FATBLICFSRIJRR-FYZOBXCZSA-N

SMILES:

C[C@H](c1ccc(cc1)SC(F)(F)F)N.Cl

Complexity:

175

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

257.025g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

257.699g/mol

Monoisotopic Mass:

257.025g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

51.3A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count: