Name: Name:2-[1-(2,2,2-trifluoroethyl)-1H-imidazol-2-yl]acetonitrile
Brand: Angene
SKU: AG01AA7J
Rating: 90 (10 reviews)

2-[1-(2,2,2-trifluoroethyl)-1H-imidazol-2-yl]acetonitrile

CAS No.:

1251923-15-5

Catalog Number:

AG01AA7J

Molecular Formula:

C7H6F3N3

Molecular Weight:

189.1378

Catalog Number:

AG01AA7J

Chemical Name:

2-[1-(2,2,2-trifluoroethyl)-1H-imidazol-2-yl]acetonitrile

CAS Number:

1251923-15-5

Molecular Formula:

C7H6F3N3

Molecular Weight:

189.1378

MDL Number:

MFCD16990655

IUPAC Name:

2-[1-(2,2,2-trifluoroethyl)imidazol-2-yl]acetonitrile

InChI:

InChI=1S/C7H6F3N3/c8-7(9,10)5-13-4-3-12-6(13)1-2-11/h3-4H,1,5H2

InChI Key:

WWHCIFNAXSSZJE-UHFFFAOYSA-N

SMILES:

N#CCc1nccn1CC(F)(F)F

Complexity:

217

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

189.051g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

189.141g/mol

Monoisotopic Mass:

189.051g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

41.6A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

0.8