Name: Name:5-bromo-3-methoxy-1-methyl-1H-pyrazole-4-carboxylic acid
Brand: Angene
SKU: AG01ELAN
Rating: 90 (10 reviews)

5-bromo-3-methoxy-1-methyl-1H-pyrazole-4-carboxylic acid

CAS No.:

1784095-49-3

Catalog Number:

AG01ELAN

Molecular Formula:

C6H7BrN2O3

Molecular Weight:

235.0354

Catalog Number:

AG01ELAN

Chemical Name:

5-bromo-3-methoxy-1-methyl-1H-pyrazole-4-carboxylic acid

CAS Number:

1784095-49-3

Molecular Formula:

C6H7BrN2O3

Molecular Weight:

235.0354

MDL Number:

MFCD31736102

IUPAC Name:

5-bromo-3-methoxy-1-methylpyrazole-4-carboxylic acid

InChI:

InChI=1S/C6H7BrN2O3/c1-9-4(7)3(6(10)11)5(8-9)12-2/h1-2H3,(H,10,11)

InChI Key:

HLVITVHVNZZHDO-UHFFFAOYSA-N

SMILES:

COc1nn(c(c1C(=O)O)Br)C

Complexity:

190

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:

64.4A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

1.1