Name: Name:METHYL 5-BROMO-6-OXO-5,6-DIHYDROPYRIDAZINE-3-CARBOXYLATE
Brand: Angene
SKU: AG01ELTJ
Rating: 90 (10 reviews)

METHYL 5-BROMO-6-OXO-5,6-DIHYDROPYRIDAZINE-3-CARBOXYLATE

CAS No.:

1823949-14-9

Catalog Number:

AG01ELTJ

Molecular Formula:

C6H5BrN2O3

Molecular Weight:

233.0195

Catalog Number:

AG01ELTJ

Chemical Name:

METHYL 5-BROMO-6-OXO-5,6-DIHYDROPYRIDAZINE-3-CARBOXYLATE

CAS Number:

1823949-14-9

Molecular Formula:

C6H5BrN2O3

Molecular Weight:

233.0195

MDL Number:

MFCD27921232

IUPAC Name:

methyl 4-bromo-3-oxo-4H-pyridazine-6-carboxylate

InChI:

InChI=1S/C6H5BrN2O3/c1-12-6(11)4-2-3(7)5(10)9-8-4/h2-3H,1H3

InChI Key:

MFMRWTKCQQYAMD-UHFFFAOYSA-N

SMILES:

COC(=O)C1=CC(Br)C(=O)N=N1

Complexity:

285

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

231.948g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

233.021g/mol

Monoisotopic Mass:

231.948g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

68.1A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

1.4