Name: Name:1-(4-chlorophenyl)-4-hydroxy-1H-pyrazole-3-carboxylic acid
Brand: Angene
SKU: AG019X6O
Rating: 90 (10 reviews)

1-(4-chlorophenyl)-4-hydroxy-1H-pyrazole-3-carboxylic acid

CAS No.:

334832-82-5

Catalog Number:

AG019X6O

Molecular Formula:

C10H7ClN2O3

Molecular Weight:

238.6272

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Product Description

Catalog Number:

AG019X6O

Chemical Name:

1-(4-chlorophenyl)-4-hydroxy-1H-pyrazole-3-carboxylic acid

CAS Number:

334832-82-5

Molecular Formula:

C10H7ClN2O3

Molecular Weight:

238.6272

MDL Number:

MFCD11133588

IUPAC Name:

1-(4-chlorophenyl)-4-hydroxypyrazole-3-carboxylic acid

InChI:

InChI=1S/C10H7ClN2O3/c11-6-1-3-7(4-2-6)13-5-8(14)9(12-13)10(15)16/h1-5,14H,(H,15,16)

InChI Key:

MFQVFEHBGPWURG-UHFFFAOYSA-N

SMILES:

Clc1ccc(cc1)n1cc(c(n1)C(=O)O)O

Properties

Complexity:

269

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

238.015g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

238.627g/mol

Monoisotopic Mass:

238.015g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

75.4A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

2.6

Literature

Title	Journal
Polysubstituted pyrazoles, part 5. Synthesis of new 1-(4-chlorophenyl)-4-hydroxy-1H-pyrazole-3-carboxylic acid hydrazide analogs and some derived ring systems. A novel class of potential antitumor and anti-HCV agents.	European journal of medicinal chemistry 20030101