Name: Name:4-Pyrimidinecarboxylic acid, 2-chloro-6-(trifluoromethyl)-
Brand: Angene
SKU: AG0030YO
Rating: 90 (10 reviews)

4-Pyrimidinecarboxylic acid, 2-chloro-6-(trifluoromethyl)-

CAS No.:

306960-80-5

Catalog Number:

AG0030YO

Molecular Formula:

C6H2ClF3N2O2

Molecular Weight:

226.5405

Catalog Number:

AG0030YO

Chemical Name:

4-Pyrimidinecarboxylic acid, 2-chloro-6-(trifluoromethyl)-

CAS Number:

306960-80-5

Molecular Formula:

C6H2ClF3N2O2

Molecular Weight:

226.5405

MDL Number:

MFCD10697913

IUPAC Name:

2-chloro-6-(trifluoromethyl)pyrimidine-4-carboxylic acid

InChI:

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

InChI Key:

NRCWKOWKCBXOBR-UHFFFAOYSA-N

SMILES:

Clc1nc(cc(n1)C(F)(F)F)C(=O)O

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:

1.9