Name: Name:4-(Ethoxycarbonyl);-1-methyl-1H-pyrazole-5-carboxylic acid
Brand: Angene
SKU: AG008MP5
Rating: 90 (10 reviews)

4-(Ethoxycarbonyl);-1-methyl-1H-pyrazole-5-carboxylic acid

CAS No.:

81303-65-3

Catalog Number:

AG008MP5

Molecular Formula:

C8H10N2O4

Molecular Weight:

198.1760

Catalog Number:

AG008MP5

Chemical Name:

4-(Ethoxycarbonyl);-1-methyl-1H-pyrazole-5-carboxylic acid

CAS Number:

81303-65-3

Molecular Formula:

C8H10N2O4

Molecular Weight:

198.1760

MDL Number:

MFCD09473474

IUPAC Name:

4-ethoxycarbonyl-2-methylpyrazole-3-carboxylic acid

InChI:

InChI=1S/C8H10N2O4/c1-3-14-8(13)5-4-9-10(2)6(5)7(11)12/h4H,3H2,1-2H3,(H,11,12)

InChI Key:

INIPCPYOESSJQP-UHFFFAOYSA-N

SMILES:

CCOC(=O)c1cnn(c1C(=O)O)C

Complexity:

244

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

198.064g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

198.178g/mol

Monoisotopic Mass:

198.064g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

81.4A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

0.3