Name: Name:3-ethyl-5-(2,2,2-trifluoroethyl)-1H-1,2,4-triazole
Brand: Angene
SKU: AG01BGJ9
Rating: 90 (10 reviews)

3-ethyl-5-(2,2,2-trifluoroethyl)-1H-1,2,4-triazole

CAS No.:

1248135-05-8

Catalog Number:

AG01BGJ9

Molecular Formula:

C6H8F3N3

Molecular Weight:

179.1430

Catalog Number:

AG01BGJ9

Chemical Name:

3-ethyl-5-(2,2,2-trifluoroethyl)-1H-1,2,4-triazole

CAS Number:

1248135-05-8

Molecular Formula:

C6H8F3N3

Molecular Weight:

179.1430

MDL Number:

MFCD14610955

IUPAC Name:

3-ethyl-5-(2,2,2-trifluoroethyl)-1H-1,2,4-triazole

InChI:

InChI=1S/C6H8F3N3/c1-2-4-10-5(12-11-4)3-6(7,8)9/h2-3H2,1H3,(H,10,11,12)

InChI Key:

PLOKFVJEYIEYLG-UHFFFAOYSA-N

SMILES:

CCc1nc([nH]n1)CC(F)(F)F

Complexity:

148

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

179.067g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

179.146g/mol

Monoisotopic Mass:

179.067g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

41.6A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

2.2