Name: Name:7-(TRIFLUOROMETHYL)-4,5,6,7-TETRAHYDROPYRAZOLO[1,5-A]PYRIMIDINE-3-CARBOXY+
Brand: Angene
SKU: AG01DTDR
Rating: 90 (10 reviews)

7-(TRIFLUOROMETHYL)-4,5,6,7-TETRAHYDROPYRAZOLO[1,5-A]PYRIMIDINE-3-CARBOXY+

CAS No.:

869948-08-3

Catalog Number:

AG01DTDR

Molecular Formula:

C8H8F3N3O2

Molecular Weight:

235.1632

Catalog Number:

AG01DTDR

Chemical Name:

7-(TRIFLUOROMETHYL)-4,5,6,7-TETRAHYDROPYRAZOLO[1,5-A]PYRIMIDINE-3-CARBOXY+

CAS Number:

869948-08-3

Molecular Formula:

C8H8F3N3O2

Molecular Weight:

235.1632

IUPAC Name:

7-(trifluoromethyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-3-carboxylic acid

InChI:

InChI=1S/C8H8F3N3O2/c9-8(10,11)5-1-2-12-6-4(7(15)16)3-13-14(5)6/h3,5,12H,1-2H2,(H,15,16)

InChI Key:

NIAZXMDUIWSZGJ-UHFFFAOYSA-N

SMILES:

OC(=O)c1cnn2c1NCCC2C(F)(F)F

Complexity:

297

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

235.057g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

235.166g/mol

Monoisotopic Mass:

235.057g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

67.2A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

1.3