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Pigment Yellow 3
CAS: 6486-23-3 | C16H12Cl2N4O4
2D Structure
3D Structure
Loading 3D structure...
Basic Information
CAS Registry Number:
6486-23-3
Molecular Formula:
C16H12Cl2N4O4
Molecular Weight:
395.202 g/mol
Names and Synonyms:
Pigment Yellow 3
Butanamide, 2-[2-(4-chloro-2-nitrophenyl)diazenyl]-N-(2-chlorophenyl)-3-oxo-
Tertropigment Yellow 10G
Tertropigment Yellow 10GT
Toluidine Yellow AH 177
Versal Yellow 10G
Vulcol Yellow 10G
α-(4-Chloro-2-nitrophenylazo)acetoacetic acid o-chloroanilide
Pigment Yellow 2ZTP
Monolite Yellow 10G
Pigment Yellow 3
Irgalite Yellow 10G
Pigment Lightfast Yellow 2Z
Pigment Lightfast Yellow 2ZTP
Hansa Yellow 10G41
Yellow 23TP
Arylide Yellow 10G
Lemon Yellow (organic pigment)
Talens Yellow Lemon
Lemon Yellow
Lutetia Yellow 10JN
Irgalite Yellow PDS 9
Sico Yellow L 0951
Levanyl Yellow 10GZ
Fast Yellow 10GH Conc.
Seikafast Yellow 10GH Conc S
Lightfast Yellow 10G
NSC 17264
Hansa Yellow 10G Pure
Aquarine Yellow 10G
Seikafast Yellow 10G Conc S
CI 11710 Yellow
Hansa Yellow 10GM
Hansa Yellow 3
PY 3
C.I. Pigment Yellow 3
Butanamide, 2-[(4-chloro-2-nitrophenyl)azo]-N-(2-chlorophenyl)-3-oxo-
Acetoacetanilide, 2′-chloro-2-(4-chloro-2-nitrophenylazo)-
2-[2-(4-Chloro-2-nitrophenyl)diazenyl]-N-(2-chlorophenyl)-3-oxobutanamide
C.I. 11710
ADC Pigment Yellow 10G
Arylamide Yellow 10G
Carnelio Yellow 10G
Chromatex Yellow 10J
Dainichi Fast Yellow 10G
Eljon Fast Primrose PV Extra
Eljon Fast Yellow 10G
Eljon Fast Yellow 10GX
Fanchon Yellow (10G) YH-4
Fastona Yellow 10G
Fast Yellow 10J
Fast Yellow 10JT
Fast Yellow 15J
Graphtol Yellow 10GL
Hancock Yellow 1007
Hansa Yellow 10G
Hansa Yellow 10GD
Hansa Yellow 10GT
Hansa Yellow 10G Extra
Hansa Yellow 10G Toner
Helio Fast Yellow 8GM
Hostaperm Yellow IOG
Irgalite Fast Yellow P 10G
Irgalite Yellow PV 4
Irgalite Yellow VG
Irgalite Yellow VGT
Irgalite Yellow VGX
Iroquois Yellow X 1285
Isol Aryl Yellow 10G
Isol Aryl Yellow 10GX
Kromon Yellow 10G Extra
Lutetia Fast Yellow 10J
Lutetia Fast Yellow 12J
Mono Fast Yellow 10G
Monolite Fast Paper Yellow 10G
Monolite Fast Yellow 10G
Monolite Fast Yellow 10GA
Monolite Fast Yellow 10GBA
Monolite Fast Yellow 10GV
Oralith Yellow 10G
Permanent Yellow Toner 10G
Permanent Yellow 10G-YT372
Permansa Yellow 10G
Pigment Yellow 10G
Polymo Yellow F 7G
Recolite Fast Yellow 10GT
Recolite Fast Yellow 10G
Sanyo Fast Yellow 10G
Segnale Light Yellow 10G
Siegle Yellow 10G
Silopol Yellow 10G
Silosol Yellow 10GN
Siloton Yellow 10GCL
Symuler Fast Yellow 10GH
Syton Fast Yellow 10G
Identifiers:
SMILES:
CC(=O)C(N=Nc1ccc(Cl)cc1[N+](=O)[O-])C(O)=Nc1ccccc1Cl
InChI:
InChI=1S/C16H12Cl2N4O4/c1-9(23)15(16(24)19-12-5-3-2-4-11(12)18)21-20-13-7-6-10(17)8-14(13)22(25)26/h2-8,15H,1H3,(H,19,24)
Spectral Data
NMR, IR, and Mass spectral data
1H NMR
13C NMR
Predicting NMR spectra...
10 ppm
9
8
7
6
5
4
3
2
1
0 ppm
| Shift (ppm) | Multiplicity | Integration | Assignment |
|---|
200 ppm
180
160
140
120
100
80
60
40
20
0 ppm
| Shift (ppm) | DEPT | Assignment |
|---|
Note: These NMR spectra are predicted computationally and may differ from experimental data. Predictions are based on chemical environment analysis.
All Properties
Comprehensive physical and chemical properties
Molecular
| Property | Value | Source |
|---|---|---|
| Molecular Weight | 395.202 g/mol | RDKit |
Exact
| Property | Value | Source |
|---|---|---|
| Exact Molecular Weight | 394.023560224 g/mol | RDKit |
Heavy
| Property | Value | Source |
|---|---|---|
| Heavy Atom Count | 26 count | RDKit |
Hydrogen
| Property | Value | Source |
|---|---|---|
| Hydrogen Bond Acceptors | 6 count | RDKit |
| Hydrogen Bond Donors | 1 count | RDKit |
Rotatable
| Property | Value | Source |
|---|---|---|
| Rotatable Bonds | 6 count | RDKit |
Aromatic
| Property | Value | Source |
|---|---|---|
| Aromatic Ring Count | 2 count | RDKit |
Topological
| Property | Value | Source |
|---|---|---|
| Topological Polar Surface Area | 117.52 Ų | RDKit |
Physical Properties
| Property | Value | Source |
|---|---|---|
| LogP | 5.231100000000002 | RDKit |
| molecular_mass | 395.20 g/mol | Legacy Database |
| cas-canonical-smile | O=C(NC=1C=CC=CC1Cl)C(N=NC2=CC=C(Cl)C=C2N(=O)=O)C(=O)C None | Legacy Database |
| cas-inchi | InChI=1S/C16H12Cl2N4O4/c1-9(23)15(16(24)19-12-5-3-2-4-11(12)18)21-20-13-7-6-10(17)8-14(13)22(25)26/h2-8,15H,1H3,(H,19,24) None | Legacy Database |
| cas-inchi-key | InChIKey=QTSNFLIDNYOATQ-UHFFFAOYSA-N None | Legacy Database |
| cas-melting-point | 230 °C @ Solvent: Ethanol None | Legacy Database |
| cas-name | Pigment Yellow 3 None | Legacy Database |
Molar
| Property | Value | Source |
|---|---|---|
| Molar Refractivity | 98.2672 | RDKit |
