Name: Name:4(3H)-Pyrimidinone, 2-(chloromethyl)-6-(trifluoromethyl)-
Brand: Angene
SKU: AG000LH5
Rating: 90 (10 reviews)

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

CAS No.:

1240596-45-5

Catalog Number:

AG000LH5

Molecular Formula:

C6H4ClF3N2O

Molecular Weight:

212.5570

Catalog Number:

AG000LH5

Chemical Name:

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

CAS Number:

1240596-45-5

Molecular Formula:

C6H4ClF3N2O

Molecular Weight:

212.5570

MDL Number:

MFCD16988122

IUPAC Name:

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

InChI:

InChI=1S/C6H4ClF3N2O/c7-2-4-11-3(6(8,9)10)1-5(13)12-4/h1H,2H2,(H,11,12,13)

InChI Key:

NWBRQKOURFWXPA-UHFFFAOYSA-N

SMILES:

ClCc1nc(cc(=O)[nH]1)C(F)(F)F

Complexity:

295

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

211.996g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

212.556g/mol

Monoisotopic Mass:

211.996g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

41.5A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

0.8