Name: Name:Benzoic acid, 2-amino-4-hydroxy-5-nitro- (9CI)
Brand: Angene
SKU: AG00EHYP
Rating: 90 (10 reviews)

Benzoic acid, 2-amino-4-hydroxy-5-nitro- (9CI)

CAS No.:

574738-65-1

Catalog Number:

AG00EHYP

Molecular Formula:

C7H6N2O5

Molecular Weight:

198.1329

Catalog Number:

AG00EHYP

Chemical Name:

Benzoic acid, 2-amino-4-hydroxy-5-nitro- (9CI)

CAS Number:

574738-65-1

Molecular Formula:

C7H6N2O5

Molecular Weight:

198.1329

MDL Number:

MFCD18825974

IUPAC Name:

2-amino-4-hydroxy-5-nitrobenzoic acid

InChI:

InChI=1S/C7H6N2O5/c8-4-2-6(10)5(9(13)14)1-3(4)7(11)12/h1-2,10H,8H2,(H,11,12)

InChI Key:

LRSAVIYRSAMFRJ-UHFFFAOYSA-N

SMILES:

[O-][N+](=O)c1cc(C(=O)O)c(cc1O)N

Complexity:

251

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

198.028g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

198.134g/mol

Monoisotopic Mass:

198.028g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

129A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

1.3