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Disperse Red 60
CAS: 17418-58-5 | C20H13NO4
2D Structure
3D Structure
Loading 3D structure...
Basic Information
CAS Registry Number:
17418-58-5
Molecular Formula:
C20H13NO4
Molecular Weight:
331.32700000000006 g/mol
Names and Synonyms:
Disperse Red 60
9,10-Anthracenedione, 1-amino-4-hydroxy-2-phenoxy-
C.I. Disperse Red 60
1-Amino-4-hydroxy-2-phenoxy-9,10-anthracenedione
1-Amino-4-hydroxy-2-phenoxyanthraquinone
1-Amino-2-phenoxy-4-hydroxyanthraquinone
Duranol Brilliant Red T 2B
Miketon Polyester Red FB
Serilene Brilliant Red 2BL
Samaron Pink FBL
Resolin Red FB
Foron Brilliant Red E 2BL
Resorin Red FBE
Resolin Red FBE
Disperse Red 60
Ostacet Brilliant Red E-LB
C.I. Disperse Red 83
Serilene Red 2BL
Resiren Red TB
Dispersol Red B 2B
Sumikaron Red E-FBL
Latyl Cerise N
Transetile Rubine P-FL
Disperse Polyester Pink 2S
Tersetile Rubine FL
Palanil Red BF
Hostatherm Pink FBL
Teraprint Red 3G
C.I. Disperse Red 71
PTR 63
Lurafix Red 430
Terasil Red FB
Navilene Red FB
Intrasil Brilliant Red 2B
MS Red G
Ostacet Red E-L 2B
Dianix Red FB-E 220
Dianix Red FB-E
Disperse Red 3B
Anthraquinone magenta
Disperse Red E 4B
C.I. Solvent Red 146
C.I. 60756
Kayaset Red B
Sumiplast Red FB
Solvent Red 146
Lumacron Red FB
Disperse Red B 2B
Disperse Red B 2B 200
Resiren Red T-FB
Intratherm Brilliant Red P 1314NT
Intrasil Brilliant Red 2B 200
Ostacet Red E-LB
Brilliant Red E 2BL
Rifalon Red E-FBL
Synten Red P-BFL
Foron Brilliant Red 2BL200
Disperse Red FB
Foron Brilliant Red E 2BL200
Plast Red 8375N
Disperse Red E 3B
Rifalon Red E-FBL 200
Zenix Red FB-E
Terasil Red FBN
Dianix Red E-FB
1-Amino-2-phenoxy-4-hydroxy-9,10-anthraquinone
Sumikaron Red E-RPD
Techcron Red E-RPD
R 60
KP Plast Red B
1-Amino-4-hydroxy-2-phenoxy-9,10-anthraquinone
1-Amino-4-hydroxy-2-phenoxy-9,10-dihydroanthracene-9,10-dione
PS Red G
Identifiers:
SMILES:
Nc1c(Oc2ccccc2)cc(O)c2c1C(=O)c1ccccc1C2=O
InChI:
InChI=1S/C20H13NO4/c21-18-15(25-11-6-2-1-3-7-11)10-14(22)16-17(18)20(24)13-9-5-4-8-12(13)19(16)23/h1-10,22H,21H2
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 | 331.32700000000006 g/mol | RDKit |
Exact
| Property | Value | Source |
|---|---|---|
| Exact Molecular Weight | 331.084457896 g/mol | RDKit |
Heavy
| Property | Value | Source |
|---|---|---|
| Heavy Atom Count | 25 count | RDKit |
Hydrogen
| Property | Value | Source |
|---|---|---|
| Hydrogen Bond Acceptors | 5 count | RDKit |
| Hydrogen Bond Donors | 2 count | RDKit |
Rotatable
| Property | Value | Source |
|---|---|---|
| Rotatable Bonds | 2 count | RDKit |
Aromatic
| Property | Value | Source |
|---|---|---|
| Aromatic Ring Count | 3 count | RDKit |
Topological
| Property | Value | Source |
|---|---|---|
| Topological Polar Surface Area | 89.62 Ų | RDKit |
Physical Properties
| Property | Value | Source |
|---|---|---|
| LogP | 3.5421000000000022 | RDKit |
| molecular_mass | 331.33 g/mol | Legacy Database |
| wikipedia_url | https://en.wikipedia.org/wiki/Disperse_Red_60 None | Legacy Database |
| cas-canonical-smile | O=C1C=2C=CC=CC2C(=O)C3=C(N)C(OC=4C=CC=CC4)=CC(O)=C13 None | Legacy Database |
| cas-inchi | InChI=1S/C20H13NO4/c21-18-15(25-11-6-2-1-3-7-11)10-14(22)16-17(18)20(24)13-9-5-4-8-12(13)19(16)23/h1-10,22H,21H2 None | Legacy Database |
| cas-inchi-key | InChIKey=MHXFWEJMQVIWDH-UHFFFAOYSA-N None | Legacy Database |
| cas-melting-point | 185 °C None | Legacy Database |
| cas-name | Disperse Red 60 None | Legacy Database |
| wikipedia-name | Disperse Red 60 None | Legacy Database |
Molar
| Property | Value | Source |
|---|---|---|
| Molar Refractivity | 92.34220000000002 | RDKit |
