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Disperse Blue 14
CAS: 2475-44-7 | C16H14N2O2
2D Structure
3D Structure
Loading 3D structure...
Basic Information
CAS Registry Number:
2475-44-7
Molecular Formula:
C16H14N2O2
Molecular Mass:
266.30 g/mol
Names and Synonyms:
Disperse Blue 14
9,10-Anthracenedione, 1,4-bis(methylamino)-
Anthraquinone, 1,4-bis(methylamino)-
1,4-Bis(methylamino)-9,10-anthracenedione
C.I. 61500
Acetate Blue B
Artisil Blue BRP
1,4-Bis(methylamino)anthraquinone
Celliton Fast Blue B
Cibacet Blue BR
Cilla Fast Blue B
C.I. Disperse Blue 14
Duranol Brilliant Blue G
Serisol Brilliant Blue G
Supracet Fast Blue 2G
Disperse Blue 14
C.I. Disperse Blue 110
Setacyl Blue BS
1,4-Bis-N-methylamino-9,10-anthraquinone
Resiren Blue TB
C.I. Disperse Blue 78
1,4-Bis(methylamino)-9,10-anthraquinone
Macrolex Blue FR
C.I. Solvent Blue 93
C.I. Solvent Blue 78
Solvent Blue 93
Disperse Blue 78
Disperse Blue 110
Solvent Blue 78
Diaresin Blue K
Sumiplast Blue GP
Plast Blue 8516
Intratherm Blue P 1404
NSC 86161
Disperse Blue B
Identifiers:
SMILES:
CNc1ccc(NC)c2c1C(=O)c1ccccc1C2=O
InChI:
InChI=1S/C16H14N2O2/c1-17-11-7-8-12(18-2)14-13(11)15(19)9-5-3-4-6-10(9)16(14)20/h3-8,17-18H,1-2H3
Key Properties
Melting Point
220 °C
CAS Common Chemistry
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
| Property | Value | Source |
|---|---|---|
| Molecular Mass | 266.30 g/mol | CAS Common Chemistry |
| 266.3 g/mol | RDKit | |
| 266.105527688 g/mol | RDKit | |
| Canonical SMILES | O=C1C=2C=CC=CC2C(=O)C=3C(=CC=C(NC)C13)NC | CAS Common Chemistry |
| InChI | InChI=1S/C16H14N2O2/c1-17-11-7-8-12(18-2)14-13(11)15(19)9-5-3-4-6-10(9)16(14)20/h3-8,17-18H,1-2H3 | CAS Common Chemistry |
| InChI Key | InChIKey=QOSTVEDABRQTSU-UHFFFAOYSA-N | CAS Common Chemistry |
| Melting Point | 220 °C | CAS Common Chemistry |
| Name | Disperse Blue 14 | CAS Common Chemistry |
| Heavy Atom Count | 20 | RDKit |
| Hydrogen Bond Acceptors | 4 | RDKit |
| Hydrogen Bond Donors | 2 | RDKit |
| Rotatable Bonds | 2 | RDKit |
| Aromatic Ring Count | 2 | RDKit |
| Topological Polar Surface Area | 58.199999999999996 Ų | RDKit |
| LogP | 2.5454000000000008 | RDKit |
| Molar Refractivity | 78.84240000000003 | RDKit |
