Name: Name:1-(3-bromophenyl)-5-methyl-1H-pyrazole-3-carboxylic acid
Brand: Angene
SKU: AG01DWO3
Rating: 90 (10 reviews)

1-(3-bromophenyl)-5-methyl-1H-pyrazole-3-carboxylic acid

CAS No.:

784142-84-3

Catalog Number:

AG01DWO3

Molecular Formula:

C11H9BrN2O2

Molecular Weight:

281.1054

Catalog Number:

AG01DWO3

Chemical Name:

1-(3-bromophenyl)-5-methyl-1H-pyrazole-3-carboxylic acid

CAS Number:

784142-84-3

Molecular Formula:

C11H9BrN2O2

Molecular Weight:

281.1054

MDL Number:

MFCD13190659

IUPAC Name:

1-(3-bromophenyl)-5-methylpyrazole-3-carboxylic acid

InChI:

InChI=1S/C11H9BrN2O2/c1-7-5-10(11(15)16)13-14(7)9-4-2-3-8(12)6-9/h2-6H,1H3,(H,15,16)

InChI Key:

SHQDQMGCSPGXQD-UHFFFAOYSA-N

SMILES:

Brc1cccc(c1)n1nc(cc1C)C(=O)O

Complexity:

275

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

279.985g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

281.109g/mol

Monoisotopic Mass:

279.985g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

55.1A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

2.8