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Pigment Yellow 83
CAS: 5567-15-7 | C36H32Cl4N6O8
2D Structure
3D Structure
Loading 3D structure...
Basic Information
CAS Registry Number:
5567-15-7
Molecular Formula:
C36H32Cl4N6O8
Molecular Weight:
818.4979999999999 g/mol
Names and Synonyms:
Pigment Yellow 83
Common Name
Levanyl Yellow HR-LF
Synonym
Benzidine Yellow HR
Synonym
HR 02
Synonym
Lionol Yellow TT 1805G
Synonym
Diacetanil Yellow HTT 8318C
Synonym
Fuji SP Yellow 4341
Synonym
Yellow HR 02
Synonym
Monolite Diarylide Yellow HR
Synonym
PV Fast Yellow HR 02
Synonym
Novoperm Yellow HR 04
Synonym
Imperon Gold Yellow K-RN
Synonym
PY 83
Synonym
Microlen Yellow B 3RS-MC
Synonym
Hostafine Yellow HR
Synonym
Irgalite Yellow B 3RN
Synonym
Novoperm Yellow HR 70
Synonym
Seikafast Yellow 2700B
Synonym
HR 70 Yellow
Synonym
Colanyl Yellow HRD
Synonym
Novoperm yellow HR 02
Synonym
2,2′-[(3,3′-Dichloro[1,1′-biphenyl]-4,4′-diyl)bis(azo)]bis[N-(4-chloro-2,5-dimethoxyphenyl)-3-oxobutanamide
Synonym
FG 1842
Synonym
Lionol Yellow FG 1842
Synonym
Lionol Yellow 1823G
Synonym
Imperon Golden Yellow K-RN
Synonym
Spectra Pac Yellow 83
Synonym
Microlith Yellow 2R-WA
Synonym
Lionol Yellow NBR
Synonym
Irgalite Yellow B 3R
Synonym
Microlith Yellow 2R-K
Synonym
Sunbrite Yellow 83 275-0570
Synonym
Hydrocolor Yellow
Synonym
Sunbrite Yellow 83
Synonym
Sunfast Yellow 83
Synonym
Seikafast Yellow 2720
Synonym
Seikafast Yellow 2700
Synonym
Microlith Yellow 2R-A
Synonym
C.I. 21108
Synonym
Symuler Fast Yellow 4181NR
Synonym
Lionol Yellow 1805G
Synonym
Sanyo Pigment Yellow IRC
Synonym
Helio Fast Yellow HRN
Synonym
Special Yellow HR
Synonym
Chromofine Yellow 2700(L)
Synonym
Sanyo Pigment Yellow TRG
Synonym
Seikafast Yellow 2770
Synonym
Imperial yellow
Synonym
Permanent Yellow HR 70
Synonym
Aquafine Yellow E 12
Synonym
Novoperm Yellow HR
Synonym
Symuler Fast Yellow 4173
Synonym
Sumitone Fast Yellow HRT
Synonym
Segnale Light Yellow R
Synonym
Symuler Fast Yellow 4181
Synonym
Pergantine Yellow 2RN-LA
Synonym
Graphtol Yellow RCL
Synonym
PV Yellow HR
Synonym
Permanent Yellow HR 11-1400
Synonym
Disazo Yellow
Synonym
Permanent Yellow HR
Synonym
Pigment Yellow 83
Synonym
PV Fast Yellow HR
Synonym
Vulcan Fast Yellow HR
Synonym
C.I. Pigment Yellow 83
Synonym
Symuler Fast Yellow HFS
Synonym
Permanent Yellow HR Extra
Synonym
2,2′-[(3,3′-Dichloro[1,1′-biphenyl]-4,4′-diyl)bis(2,1-diazenediyl)]bis[N-(4-chloro-2,5-dimethoxyphenyl)-3-oxobutanamide]
Synonym
Butanamide, 2,2′-[(3,3′-dichloro[1,1′-biphenyl]-4,4′-diyl)bis(azo)]bis[N-(4-chloro-2,5-dimethoxyphenyl)-3-oxo-
Synonym
Acetoacetanilide, 2,2′′-[(3,3′-dichloro-4,4′-biphenylylene)bis(azo)]bis[4′-chloro-2′,5′-dimethoxy-
Synonym
Butanamide, 2,2′-[(3,3′-dichloro[1,1′-biphenyl]-4,4′-diyl)bis(2,1-diazenediyl)]bis[N-(4-chloro-2,5-dimethoxyphenyl)-3-oxo-
Synonym
Identifiers:
SMILES:
COc1cc(N=C(O)C(N=Nc2ccc(-c3ccc(N=NC(C(C)=O)C(O)=Nc4cc(OC)c(Cl)cc4OC)c(Cl)c3)cc2Cl)C(C)=O)c(OC)cc1Cl
InChI:
InChI=1S/C36H32Cl4N6O8/c1-17(47)33(35(49)41-27-15-29(51-3)23(39)13-31(27)53-5)45-43-25-9-7-19(11-21(25)37)20-8-10-26(22(38)12-20)44-46-34(18(2)48)36(50)42-28-16-30(52-4)24(40)14-32(28)54-6/h7-16,33-34H,1-6H3,(H,41,49)(H,42,50)
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 | 818.4979999999999 g/mol | RDKit |
Exact
| Property | Value | Source |
|---|---|---|
| Exact Molecular Weight | 816.103572704 g/mol | RDKit |
Heavy
| Property | Value | Source |
|---|---|---|
| Heavy Atom Count | 54 count | RDKit |
Hydrogen
| Property | Value | Source |
|---|---|---|
| Hydrogen Bond Acceptors | 12 count | RDKit |
| Hydrogen Bond Donors | 2 count | RDKit |
Rotatable
| Property | Value | Source |
|---|---|---|
| Rotatable Bonds | 15 count | RDKit |
Aromatic
| Property | Value | Source |
|---|---|---|
| Aromatic Ring Count | 4 count | RDKit |
Topological
| Property | Value | Source |
|---|---|---|
| Topological Polar Surface Area | 185.67999999999992 Ų | RDKit |
Physical Properties
| Property | Value | Source |
|---|---|---|
| LogP | 10.66059999999999 | RDKit |
| molecular_mass | 818.50 g/mol | Legacy Database |
| cas-canonical-smile | O=C(NC1=CC(OC)=C(Cl)C=C1OC)C(N=NC=2C=CC(=CC2Cl)C3=CC=C(N=NC(C(=O)NC4=CC(OC)=C(Cl)C=C4OC)C(=O)C)C(Cl)=C3)C(=O)C None | Legacy Database |
| cas-inchi | InChI=1S/C36H32Cl4N6O8/c1-17(47)33(35(49)41-27-15-29(51-3)23(39)13-31(27)53-5)45-43-25-9-7-19(11-21(25)37)20-8-10-26(22(38)12-20)44-46-34(18(2)48)36(50)42-28-16-30(52-4)24(40)14-32(28)54-6/h7-16,33-34H,1-6H3,(H,41,49)(H,42,50) None | Legacy Database |
| cas-inchi-key | InChIKey=NKXPXRNUMARIMZ-UHFFFAOYSA-N None | Legacy Database |
| cas-name | Pigment Yellow 83 None | Legacy Database |
Molar
| Property | Value | Source |
|---|---|---|
| Molar Refractivity | 208.42759999999964 | RDKit |