Name: Name:4-Chloro-2-(trifluoromethyl);pyrimidine-5-carboxylic acid
Brand: Angene
SKU: AG007W4T
Rating: 90 (10 reviews)

4-Chloro-2-(trifluoromethyl);pyrimidine-5-carboxylic acid

CAS No.:

1076197-55-1

Catalog Number:

AG007W4T

Molecular Formula:

C6H2ClF3N2O2

Molecular Weight:

226.5405

Catalog Number:

AG007W4T

Chemical Name:

4-Chloro-2-(trifluoromethyl);pyrimidine-5-carboxylic acid

CAS Number:

1076197-55-1

Molecular Formula:

C6H2ClF3N2O2

Molecular Weight:

226.5405

IUPAC Name:

4-chloro-2-(trifluoromethyl)pyrimidine-5-carboxylic acid

InChI:

InChI=1S/C6H2ClF3N2O2/c7-3-2(4(13)14)1-11-5(12-3)6(8,9)10/h1H,(H,13,14)

InChI Key:

GMZOIVPQSFJUDK-UHFFFAOYSA-N

SMILES:

OC(=O)c1cnc(nc1Cl)C(F)(F)F

Complexity:

236

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

225.976g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

226.539g/mol

Monoisotopic Mass:

225.976g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

63.1A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

1.6