Name: Name:3-(4-aminophenyl)-1-methyl-1H-pyrazole-4-carboxylic acid
Brand: Angene
SKU: AG019WTV
Rating: 90 (10 reviews)

3-(4-aminophenyl)-1-methyl-1H-pyrazole-4-carboxylic acid

CAS No.:

1197965-65-3

Catalog Number:

AG019WTV

Molecular Formula:

C11H11N3O2

Molecular Weight:

217.2239

Catalog Number:

AG019WTV

Chemical Name:

3-(4-aminophenyl)-1-methyl-1H-pyrazole-4-carboxylic acid

CAS Number:

1197965-65-3

Molecular Formula:

C11H11N3O2

Molecular Weight:

217.2239

MDL Number:

MFCD12913206

IUPAC Name:

3-(4-aminophenyl)-1-methylpyrazole-4-carboxylic acid

InChI:

InChI=1S/C11H11N3O2/c1-14-6-9(11(15)16)10(13-14)7-2-4-8(12)5-3-7/h2-6H,12H2,1H3,(H,15,16)

InChI Key:

YVJTZYQAEADMNF-UHFFFAOYSA-N

SMILES:

OC(=O)c1cn(nc1c1ccc(cc1)N)C

Complexity:

264

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

217.085g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

217.228g/mol

Monoisotopic Mass:

217.085g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

81.1A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

0.7