Name: Name:4-hydroxy-1-methyl-1H-pyrazole-3,5-dicarboxylic acid
Brand: Angene
SKU: AG01BDGD
Rating: 90 (10 reviews)

4-hydroxy-1-methyl-1H-pyrazole-3,5-dicarboxylic acid

CAS No.:

1803602-02-9

Catalog Number:

AG01BDGD

Molecular Formula:

C6H6N2O5

Molecular Weight:

186.1222

Catalog Number:

AG01BDGD

Chemical Name:

4-hydroxy-1-methyl-1H-pyrazole-3,5-dicarboxylic acid

CAS Number:

1803602-02-9

Molecular Formula:

C6H6N2O5

Molecular Weight:

186.1222

MDL Number:

MFCD28145200

IUPAC Name:

4-hydroxy-1-methylpyrazole-3,5-dicarboxylic acid

InChI:

InChI=1S/C6H6N2O5/c1-8-3(6(12)13)4(9)2(7-8)5(10)11/h9H,1H3,(H,10,11)(H,12,13)

InChI Key:

GKFAQEIITJIACL-UHFFFAOYSA-N

SMILES:

OC(=O)c1nn(c(c1O)C(=O)O)C

Complexity:

243

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

186.028g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

186.123g/mol

Monoisotopic Mass:

186.028g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

113A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

0.1