Name: Name:4-Nitro-1-phenyl-1H-pyrazole-3-carboxylic acid
Brand: Angene
SKU: AG005KPW
Rating: 90 (10 reviews)

4-Nitro-1-phenyl-1H-pyrazole-3-carboxylic acid

CAS No.:

701917-03-5

Catalog Number:

AG005KPW

Molecular Formula:

C10H7N3O4

Molecular Weight:

233.1803

Catalog Number:

AG005KPW

Chemical Name:

4-Nitro-1-phenyl-1H-pyrazole-3-carboxylic acid

CAS Number:

701917-03-5

Molecular Formula:

C10H7N3O4

Molecular Weight:

233.1803

MDL Number:

MFCD20484387

IUPAC Name:

4-nitro-1-phenylpyrazole-3-carboxylic acid

InChI:

InChI=1S/C10H7N3O4/c14-10(15)9-8(13(16)17)6-12(11-9)7-4-2-1-3-5-7/h1-6H,(H,14,15)

InChI Key:

HZENRRKFQYHSJU-UHFFFAOYSA-N

SMILES:

[O-][N+](=O)c1cn(nc1C(=O)O)c1ccccc1

Complexity:

311

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

233.044g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

233.183g/mol

Monoisotopic Mass:

233.044g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

101A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

1.6