Name: Name:1-(6-Bromopyridin-3-yl)-2,2,2-trifluoroethanone hydrate
Brand: Angene
SKU: AG01FOV6
Rating: 90 (10 reviews)

1-(6-Bromopyridin-3-yl)-2,2,2-trifluoroethanone hydrate

CAS No.:

1956366-86-1

Catalog Number:

AG01FOV6

Molecular Formula:

C7H5BrF3NO2

Molecular Weight:

272.0193

Catalog Number:

AG01FOV6

Chemical Name:

1-(6-Bromopyridin-3-yl)-2,2,2-trifluoroethanone hydrate

CAS Number:

1956366-86-1

Molecular Formula:

C7H5BrF3NO2

Molecular Weight:

272.0193

MDL Number:

MFCD28016685

IUPAC Name:

1-(6-bromopyridin-3-yl)-2,2,2-trifluoroethanone;hydrate

InChI:

InChI=1S/C7H3BrF3NO.H2O/c8-5-2-1-4(3-12-5)6(13)7(9,10)11;/h1-3H;1H2

InChI Key:

IOQFSBONCAURNN-UHFFFAOYSA-N

SMILES:

Brc1ccc(cn1)C(=O)C(F)(F)F.O

Complexity:

206

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

270.946g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

272.021g/mol

Monoisotopic Mass:

270.946g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

31A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count: