Name: Name:5-methyl-2-(trifluoromethyl)-[1,2,4]triazolo[1,5-a]pyrimidine-7-carboxylic acid
Brand: Angene
SKU: AG01AC63
Rating: 90 (10 reviews)

5-methyl-2-(trifluoromethyl)-[1,2,4]triazolo[1,5-a]pyrimidine-7-carboxylic acid

CAS No.:

1038261-10-7

Catalog Number:

AG01AC63

Molecular Formula:

C8H5F3N4O2

Molecular Weight:

246.1461

Catalog Number:

AG01AC63

Chemical Name:

5-methyl-2-(trifluoromethyl)-[1,2,4]triazolo[1,5-a]pyrimidine-7-carboxylic acid

CAS Number:

1038261-10-7

Molecular Formula:

C8H5F3N4O2

Molecular Weight:

246.1461

MDL Number:

MFCD11168136

IUPAC Name:

5-methyl-2-(trifluoromethyl)-[1,2,4]triazolo[1,5-a]pyrimidine-7-carboxylic acid

InChI:

InChI=1S/C8H5F3N4O2/c1-3-2-4(5(16)17)15-7(12-3)13-6(14-15)8(9,10)11/h2H,1H3,(H,16,17)

InChI Key:

SWQMWFCDBDSECP-UHFFFAOYSA-N

SMILES:

Cc1nc2nc(nn2c(c1)C(=O)O)C(F)(F)F

Complexity:

324

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

246.036g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

246.149g/mol

Monoisotopic Mass:

246.036g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

80.4A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

1.3