Name: Name:1-[5-(trifluoromethyl)-4H-1,2,4-triazol-3-yl]ethan-1-amine hydrochloride
Brand: Angene
SKU: AG01EI8H
Rating: 90 (10 reviews)

1-[5-(trifluoromethyl)-4H-1,2,4-triazol-3-yl]ethan-1-amine hydrochloride

CAS No.:

2126162-84-1

Catalog Number:

AG01EI8H

Molecular Formula:

C5H8ClF3N4

Molecular Weight:

216.5920

Catalog Number:

AG01EI8H

Chemical Name:

1-[5-(trifluoromethyl)-4H-1,2,4-triazol-3-yl]ethan-1-amine hydrochloride

CAS Number:

2126162-84-1

Molecular Formula:

C5H8ClF3N4

Molecular Weight:

216.5920

MDL Number:

MFCD31381457

IUPAC Name:

1-[3-(trifluoromethyl)-1H-1,2,4-triazol-5-yl]ethanamine;hydrochloride

InChI:

InChI=1S/C5H7F3N4.ClH/c1-2(9)3-10-4(12-11-3)5(6,7)8;/h2H,9H2,1H3,(H,10,11,12);1H

InChI Key:

JZJIJZBCCJIFJU-UHFFFAOYSA-N

SMILES:

CC(c1nnc([nH]1)C(F)(F)F)N.Cl

Complexity:

159

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

216.039g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

216.592g/mol

Monoisotopic Mass:

216.039g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

67.6A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count: