Name: Name:1H-Pyrazole-3-carboxylic acid, 4-amino-1-(4-methoxyphenyl)-
Brand: Angene
SKU: AG000P3I
Rating: 90 (10 reviews)

1H-Pyrazole-3-carboxylic acid, 4-amino-1-(4-methoxyphenyl)-

CAS No.:

1190305-94-2

Catalog Number:

AG000P3I

Molecular Formula:

C11H11N3O3

Molecular Weight:

233.2233

Catalog Number:

AG000P3I

Chemical Name:

1H-Pyrazole-3-carboxylic acid, 4-amino-1-(4-methoxyphenyl)-

CAS Number:

1190305-94-2

Molecular Formula:

C11H11N3O3

Molecular Weight:

233.2233

MDL Number:

MFCD28977481

IUPAC Name:

4-amino-1-(4-methoxyphenyl)pyrazole-3-carboxylic acid

InChI:

InChI=1S/C11H11N3O3/c1-17-8-4-2-7(3-5-8)14-6-9(12)10(13-14)11(15)16/h2-6H,12H2,1H3,(H,15,16)

InChI Key:

HYVQKYMBTLXQNX-UHFFFAOYSA-N

SMILES:

COc1ccc(cc1)n1cc(c(n1)C(=O)O)N

Complexity:

279

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

233.08g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

233.227g/mol

Monoisotopic Mass:

233.08g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

90.4A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

1.6