Name: Name:4(3H)-Pyrimidinone, 2-phenyl-6-(trifluoromethyl)-
Brand: Angene
SKU: AG001QRY
Rating: 90 (10 reviews)

4(3H)-Pyrimidinone, 2-phenyl-6-(trifluoromethyl)-

CAS No.:

158715-14-1

Catalog Number:

AG001QRY

Molecular Formula:

C11H7F3N2O

Molecular Weight:

240.1813

Catalog Number:

AG001QRY

Chemical Name:

4(3H)-Pyrimidinone, 2-phenyl-6-(trifluoromethyl)-

CAS Number:

158715-14-1

Molecular Formula:

C11H7F3N2O

Molecular Weight:

240.1813

MDL Number:

MFCD00205238

IUPAC Name:

2-phenyl-4-(trifluoromethyl)-1H-pyrimidin-6-one

InChI:

InChI=1S/C11H7F3N2O/c12-11(13,14)8-6-9(17)16-10(15-8)7-4-2-1-3-5-7/h1-6H,(H,15,16,17)

InChI Key:

SMUCGWAIODOUCG-UHFFFAOYSA-N

SMILES:

O=c1cc(nc([nH]1)c1ccccc1)C(F)(F)F

Complexity:

379

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

240.051g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

240.185g/mol

Monoisotopic Mass:

240.051g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

41.5A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

1.8