Name: Name:methyl 4-bromo-5-hydroxy-1-methyl-1H-pyrazole-3-carboxylate
Brand: Angene
SKU: AG01C7GJ
Rating: 90 (10 reviews)

methyl 4-bromo-5-hydroxy-1-methyl-1H-pyrazole-3-carboxylate

CAS No.:

58364-95-7

Catalog Number:

AG01C7GJ

Molecular Formula:

C6H7BrN2O3

Molecular Weight:

235.0354

Catalog Number:

AG01C7GJ

Chemical Name:

methyl 4-bromo-5-hydroxy-1-methyl-1H-pyrazole-3-carboxylate

CAS Number:

58364-95-7

Molecular Formula:

C6H7BrN2O3

Molecular Weight:

235.0354

MDL Number:

MFCD31436996

IUPAC Name:

methyl 4-bromo-2-methyl-3-oxo-1H-pyrazole-5-carboxylate

InChI:

InChI=1S/C6H7BrN2O3/c1-9-5(10)3(7)4(8-9)6(11)12-2/h8H,1-2H3

InChI Key:

WBWZOEQCUFSYQG-UHFFFAOYSA-N

SMILES:

COC(=O)c1nn(c(c1Br)O)C

Complexity:

274

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

233.964g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

235.037g/mol

Monoisotopic Mass:

233.964g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

58.6A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

0.9