Name: Name:1-(4-Nitrophenyl)-1H-pyrazole-4-carboxylic acid
Brand: Angene
SKU: AG00JB0E
Rating: 90 (10 reviews)

1-(4-Nitrophenyl)-1H-pyrazole-4-carboxylic acid

CAS No.:

68287-79-6

Catalog Number:

AG00JB0E

Molecular Formula:

C10H7N3O4

Molecular Weight:

233.1803

Catalog Number:

AG00JB0E

Chemical Name:

1-(4-Nitrophenyl)-1H-pyrazole-4-carboxylic acid

CAS Number:

68287-79-6

Molecular Formula:

C10H7N3O4

Molecular Weight:

233.1803

MDL Number:

MFCD08696936

IUPAC Name:

1-(4-nitrophenyl)pyrazole-4-carboxylic acid

InChI:

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

InChI Key:

FHLYLGPMPNMDKU-UHFFFAOYSA-N

SMILES:

[O-][N+](=O)c1ccc(cc1)n1ncc(c1)C(=O)O

Complexity:

309

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:

1.2