CAS 15516-60-6 | Benzoic acid, 2-hydroxy-5-nitroso- | CAS Number 15516-60-6

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15516-60-6 | Benzoic acid, 2-hydroxy-5-nitroso-

CAS No: 15516-60-6 Catalog No: AG001NOL MDL No:

Product Description

Catalog Number:

AG001NOL

Chemical Name:

Benzoic acid, 2-hydroxy-5-nitroso-

CAS Number:

15516-60-6

Molecular Formula:

C7H5NO4

Molecular Weight:

167.1189

IUPAC Name:

2-hydroxy-5-nitrosobenzoic acid

InChI:

InChI=1S/C7H5NO4/c9-6-2-1-4(8-12)3-5(6)7(10)11/h1-3,9H,(H,10,11)

InChI Key:

UNQLIDLZZNHURS-UHFFFAOYSA-N

SMILES:

O=Nc1ccc(c(c1)C(=O)O)O

Properties

Complexity:

194

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

167.022g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

167.12g/mol

Monoisotopic Mass:

167.022g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

87A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

1.9

Literature

Title	Journal
Cα-C bond cleavage of the peptide backbone in MALDI in-source decay using salicylic acid derivative matrices.	Journal of the American Society for Mass Spectrometry 20110701
Guest-controlling effects on ER behaviors of beta-cyclodextrin polymer.	Journal of colloid and interface science 20050901
Equilibrium studies on chromium(III) complexes of salicylic acid and salicylic acid derivatives in aqueous solution.	Chemical & pharmaceutical bulletin 20041101