Name: Name:1-(3,5-dichloropyridin-2-yl)-5-(trifluoromethyl)-1H-pyrazole-4-carboxylic acid
Brand: Angene
SKU: AG01AGOS
Rating: 90 (10 reviews)

1-(3,5-dichloropyridin-2-yl)-5-(trifluoromethyl)-1H-pyrazole-4-carboxylic acid

CAS No.:

1265323-91-8

Catalog Number:

AG01AGOS

Molecular Formula:

C10H4Cl2F3N3O2

Molecular Weight:

326.0589

Catalog Number:

AG01AGOS

Chemical Name:

1-(3,5-dichloropyridin-2-yl)-5-(trifluoromethyl)-1H-pyrazole-4-carboxylic acid

CAS Number:

1265323-91-8

Molecular Formula:

C10H4Cl2F3N3O2

Molecular Weight:

326.0589

MDL Number:

MFCD18089505

IUPAC Name:

1-(3,5-dichloropyridin-2-yl)-5-(trifluoromethyl)pyrazole-4-carboxylic acid

InChI:

InChI=1S/C10H4Cl2F3N3O2/c11-4-1-6(12)8(16-2-4)18-7(10(13,14)15)5(3-17-18)9(19)20/h1-3H,(H,19,20)

InChI Key:

HFQVASHHJCLSHD-UHFFFAOYSA-N

SMILES:

Clc1cnc(c(c1)Cl)n1ncc(c1C(F)(F)F)C(=O)O

Complexity:

385

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

324.963g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

326.056g/mol

Monoisotopic Mass:

324.963g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

68A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

2.9