Name: Name:3-Pyridinecarboxylic acid,5-bromo-2-chloro-1,6-dihydro-1-methyl-6-oxo-, methyl ester
Brand: Angene
SKU: AG00IE9K
Rating: 90 (10 reviews)

3-Pyridinecarboxylic acid,5-bromo-2-chloro-1,6-dihydro-1-methyl-6-oxo-, methyl ester

CAS No.:

869357-63-1

Catalog Number:

AG00IE9K

Molecular Formula:

C8H7BrClNO3

Molecular Weight:

280.5031

Catalog Number:

AG00IE9K

Chemical Name:

3-Pyridinecarboxylic acid,5-bromo-2-chloro-1,6-dihydro-1-methyl-6-oxo-, methyl ester

CAS Number:

869357-63-1

Molecular Formula:

C8H7BrClNO3

Molecular Weight:

280.5031

MDL Number:

MFCD26395170

IUPAC Name:

methyl 5-bromo-2-chloro-1-methyl-6-oxopyridine-3-carboxylate

InChI:

InChI=1S/C8H7BrClNO3/c1-11-6(10)4(8(13)14-2)3-5(9)7(11)12/h3H,1-2H3

InChI Key:

IYLZPYDLUUPCMM-UHFFFAOYSA-N

SMILES:

COC(=O)c1cc(Br)c(=O)n(c1Cl)C

Complexity:

362

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

278.93g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

280.502g/mol

Monoisotopic Mass:

278.93g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

46.6A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

1.7