Record Information |
---|
Version | 1.0 |
---|
Creation Date | 2016-05-19 01:34:28 UTC |
---|
Update Date | 2016-11-09 01:09:16 UTC |
---|
Accession Number | CHEM004090 |
---|
Identification |
---|
Common Name | C.I. Solvent Yellow 3 |
---|
Class | Small Molecule |
---|
Description | Not Available |
---|
Contaminant Sources | - Clean Air Act Chemicals
- HPV EPA Chemicals
- IARC Carcinogens Group 2B
- My Exposome Chemicals
- ToxCast & Tox21 Chemicals
|
---|
Contaminant Type | Not Available |
---|
Chemical Structure | |
---|
Synonyms | Value | Source |
---|
C.I. solvent yellow 3 | Kegg |
|
---|
Chemical Formula | C14H15N3 |
---|
Average Molecular Mass | 225.295 g/mol |
---|
Monoisotopic Mass | 225.127 g/mol |
---|
CAS Registry Number | 97-56-3 |
---|
IUPAC Name | 2-methyl-4-[(E)-2-(2-methylphenyl)diazen-1-yl]aniline |
---|
Traditional Name | butter yellow |
---|
SMILES | CC1=CC(=CC=C1N)\N=N\C1=CC=CC=C1C |
---|
InChI Identifier | InChI=1S/C14H15N3/c1-10-5-3-4-6-14(10)17-16-12-7-8-13(15)11(2)9-12/h3-9H,15H2,1-2H3/b17-16+ |
---|
InChI Key | PFRYFZZSECNQOL-WUKNDPDISA-N |
---|
Chemical Taxonomy |
---|
Description | belongs to the class of organic compounds known as azobenzenes. These are organonitrogen aromatic compounds that contain a central azo group, where each nitrogen atom is conjugated to a benzene ring. |
---|
Kingdom | Organic compounds |
---|
Super Class | Organoheterocyclic compounds |
---|
Class | Azobenzenes |
---|
Sub Class | Not Available |
---|
Direct Parent | Azobenzenes |
---|
Alternative Parents | |
---|
Substituents | - Azobenzene
- Aniline or substituted anilines
- Aminotoluene
- Toluene
- Monocyclic benzene moiety
- Benzenoid
- Azo compound
- Propargyl-type 1,3-dipolar organic compound
- Organic 1,3-dipolar compound
- Organopnictogen compound
- Organic nitrogen compound
- Primary amine
- Organonitrogen compound
- Amine
- Hydrocarbon derivative
- Aromatic homomonocyclic compound
|
---|
Molecular Framework | Aromatic homomonocyclic compounds |
---|
External Descriptors | |
---|
Biological Properties |
---|
Status | Detected and Not Quantified |
---|
Origin | Not Available |
---|
Cellular Locations | Not Available |
---|
Biofluid Locations | Not Available |
---|
Tissue Locations | Not Available |
---|
Pathways | Not Available |
---|
Applications | Not Available |
---|
Biological Roles | Not Available |
---|
Chemical Roles | Not Available |
---|
Physical Properties |
---|
State | Not Available |
---|
Appearance | Not Available |
---|
Experimental Properties | Property | Value |
---|
Melting Point | Not Available | Boiling Point | Not Available | Solubility | Not Available |
|
---|
Predicted Properties | |
---|
Spectra |
---|
Spectra | |
---|
Toxicity Profile |
---|
Route of Exposure | Not Available |
---|
Mechanism of Toxicity | Not Available |
---|
Metabolism | Not Available |
---|
Toxicity Values | Not Available |
---|
Lethal Dose | Not Available |
---|
Carcinogenicity (IARC Classification) | Not Available |
---|
Uses/Sources | Not Available |
---|
Minimum Risk Level | Not Available |
---|
Health Effects | Not Available |
---|
Symptoms | Not Available |
---|
Treatment | Not Available |
---|
Concentrations |
---|
| Not Available |
---|
External Links |
---|
DrugBank ID | Not Available |
---|
HMDB ID | Not Available |
---|
FooDB ID | Not Available |
---|
Phenol Explorer ID | Not Available |
---|
KNApSAcK ID | Not Available |
---|
BiGG ID | Not Available |
---|
BioCyc ID | Not Available |
---|
METLIN ID | Not Available |
---|
PDB ID | Not Available |
---|
Wikipedia Link | Not Available |
---|
Chemspider ID | Not Available |
---|
ChEBI ID | Not Available |
---|
PubChem Compound ID | Not Available |
---|
Kegg Compound ID | C19188 |
---|
YMDB ID | Not Available |
---|
ECMDB ID | Not Available |
---|
References |
---|
Synthesis Reference | Not Available |
---|
MSDS | Not Available |
---|
General References | Not Available |
---|