Name: Name:1H-Pyrazole-5-carboxylic acid, 3-bromo-1-(2-chlorophenyl)-
Brand: Angene
SKU: AG00IEDE
Rating: 90 (10 reviews)

1H-Pyrazole-5-carboxylic acid, 3-bromo-1-(2-chlorophenyl)-

CAS No.:

871239-17-7

Catalog Number:

AG00IEDE

Molecular Formula:

C10H6BrClN2O2

Molecular Weight:

301.5238

Catalog Number:

AG00IEDE

Chemical Name:

1H-Pyrazole-5-carboxylic acid, 3-bromo-1-(2-chlorophenyl)-

CAS Number:

871239-17-7

Molecular Formula:

C10H6BrClN2O2

Molecular Weight:

301.5238

MDL Number:

MFCD16683351

IUPAC Name:

5-bromo-2-(2-chlorophenyl)pyrazole-3-carboxylic acid

InChI:

InChI=1S/C10H6BrClN2O2/c11-9-5-8(10(15)16)14(13-9)7-4-2-1-3-6(7)12/h1-5H,(H,15,16)

InChI Key:

YTIZKCSYDWNCRM-UHFFFAOYSA-N

SMILES:

Brc1nn(c(c1)C(=O)O)c1ccccc1Cl

Complexity:

280

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

299.93g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

301.524g/mol

Monoisotopic Mass:

299.93g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

55.1A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

3.4