Record Information
Version1.0
Creation Date2026-04-06 14:50:10 UTC
Update Date2026-04-17 16:16:18 UTC
Accession NumberCHEM126588
Identification
Common NameC.I. Pigment Orange 79
ClassSmall Molecule
DescriptionC.I. Pigment Orange 79 belongs to the naphthalene sulfonic acids and derivatives, a subclass of naphthalenes within the organic compounds. It has the chemical formula C34H22N4O12S2Sr. With an average molecular weight of 830.30 g/mol, C.I. Pigment Orange 79 is a heavy molecule. It is further classified within the superclass of benzenoids.
Contaminant SourcesNot Available
Contaminant TypeNot Available
Chemical Structure
Thumb
SynonymsNot Available
Chemical FormulaC34H22N4O12S2Sr
Average Molecular MassNot Available
Monoisotopic Mass825.981 g/mol
CAS Registry Number250640-08-5
IUPAC NameNot Available
Traditional NameNot Available
SMILESC1=CC(=CC=C1C(=O)O)N=NC2=C(C=CC3=C2C=CC(=C3)S(=O)(=O)[O-])O.C1=CC(=CC=C1C(=O)O)N=NC2=C(C=CC3=C2C=CC(=C3)S(=O)(=O)[O-])O.[Sr+2]
InChI IdentifierInChI=1S/2C17H12N2O6S.Sr/c2*20-15-8-3-11-9-13(26(23,24)25)6-7-14(11)16(15)19-18-12-4-1-10(2-5-12)17(21)22;/h2*1-9,20H,(H,21,22)(H,23,24,25);/q;;+2/p-2
InChI KeySSMSZSIFKGCIHN-UHFFFAOYSA-L
Chemical Taxonomy
ClassificationNot classified
Biological Properties
StatusDetected and Not Quantified
OriginNot Available
Cellular LocationsNot Available
Biofluid LocationsNot Available
Tissue LocationsNot Available
PathwaysNot Available
ApplicationsNot Available
Biological RolesNot Available
Chemical RolesNot Available
Physical Properties
StateNot Available
AppearanceNot Available
Experimental Properties
PropertyValue
Melting PointNot Available
Boiling PointNot Available
SolubilityNot Available
Predicted PropertiesNot Available
Spectra
Spectra
Spectrum TypeDescriptionSplash KeyView
Toxicity Profile
Route of ExposureNot Available
Mechanism of ToxicityNot Available
MetabolismNot Available
Toxicity ValuesNot Available
Lethal DoseNot Available
Carcinogenicity (IARC Classification)Not Available
Uses/SourcesNot Available
Minimum Risk LevelNot Available
Health EffectsNot Available
SymptomsNot Available
TreatmentNot Available
Concentrations
Not Available
IdentifiersNot Available
References
Synthesis ReferenceNot Available
MSDSNot Available
General ReferencesNot Available