Name: Name:1-(4-fluorophenyl)-4,6-dioxo-1,4,5,6-tetrahydropyridazine-3-carboxylic acid
Brand: Angene
SKU: AG01BH41
Rating: 90 (10 reviews)

1-(4-fluorophenyl)-4,6-dioxo-1,4,5,6-tetrahydropyridazine-3-carboxylic acid

CAS No.:

1803600-92-1

Catalog Number:

AG01BH41

Molecular Formula:

C11H7FN2O4

Molecular Weight:

250.1827

Catalog Number:

AG01BH41

Chemical Name:

1-(4-fluorophenyl)-4,6-dioxo-1,4,5,6-tetrahydropyridazine-3-carboxylic acid

CAS Number:

1803600-92-1

Molecular Formula:

C11H7FN2O4

Molecular Weight:

250.1827

MDL Number:

MFCD28145246

IUPAC Name:

1-(4-fluorophenyl)-4,6-dioxopyridazine-3-carboxylic acid

InChI:

InChI=1S/C11H7FN2O4/c12-6-1-3-7(4-2-6)14-9(16)5-8(15)10(13-14)11(17)18/h1-4H,5H2,(H,17,18)

InChI Key:

HTYMKHSFIQOQQY-UHFFFAOYSA-N

SMILES:

Fc1ccc(cc1)N1N=C(C(=O)O)C(=O)CC1=O

Complexity:

427

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

250.039g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

250.185g/mol

Monoisotopic Mass:

250.039g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

87A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

1.4