Name: Name:1H-Indazole-3-carboxylic acid, 1-methyl-5-nitro-
Brand: Angene
SKU: AG0011Q3
Rating: 90 (10 reviews)

1H-Indazole-3-carboxylic acid, 1-methyl-5-nitro-

CAS No.:

1363382-25-5

Catalog Number:

AG0011Q3

Molecular Formula:

C9H7N3O4

Molecular Weight:

221.1696

Catalog Number:

AG0011Q3

Chemical Name:

1H-Indazole-3-carboxylic acid, 1-methyl-5-nitro-

CAS Number:

1363382-25-5

Molecular Formula:

C9H7N3O4

Molecular Weight:

221.1696

MDL Number:

MFCD20924365

IUPAC Name:

1-methyl-5-nitroindazole-3-carboxylic acid

InChI:

InChI=1S/C9H7N3O4/c1-11-7-3-2-5(12(15)16)4-6(7)8(10-11)9(13)14/h2-4H,1H3,(H,13,14)

InChI Key:

LTGCETNXDDEADX-UHFFFAOYSA-N

SMILES:

[O-][N+](=O)c1ccc2c(c1)c(nn2C)C(=O)O

Complexity:

316

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

221.044g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

221.172g/mol

Monoisotopic Mass:

221.044g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

101A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

1.3