chempirical

Pigment yellow 13

C36H34Cl2N6O4CAS 5102-83-0685.61 g/mol

Open in Covalent MOL file
ONNNNOOHNClClONH
Aryl halideAzoKetone

Properties

Molecular formula
C36H34Cl2N6O4
Molar mass
685.61 g/mol
Exact mass
684.2019 Da
logP
10.55Crippen estimate
Polar surface area
148.8 Ų
H-bond donors / acceptors
2 / 8
Rotatable bonds
11

Hazards

No GHS classification is on file for this compound. That is not evidence that it is harmless. Search the SDS library

Identifiers

CAS number
5102-83-0
SMILES
CC(=O)C(N=Nc1ccc(-c2ccc(N=NC(C(C)=O)C(O)=Nc3ccc(C)cc3C)c(Cl)c2)cc1Cl)C(O)=Nc1ccc(C)cc1C
InChIKey
IAFBRPFISOTXSO-UHFFFAOYSA-N
InChI
InChI=1S/C36H34Cl2N6O4/c1-19-7-11-29(21(3)15-19)39-35(47)33(23(5)45)43-41-31-13-9-25(17-27(31)37)26-10-14-32(28(38)18-26)42-44-34(24(6)46)36(48)40-30-12-8-20(2)16-22(30)4/h7-18,33-34H,1-6H3,(H,39,47)(H,40,48)

Weigh it out

Type any one amount. The others follow from the molar mass.

Names and synonyms

87 names · show all
  • Butanamide, 2,2′-[(3,3′-dichloro[1,1′-biphenyl]-4,4′-diyl)bis(2,1-diazenediyl)]bis[N-(2,4-dimethylphenyl)-3-oxo-
  • Cromophtal yellow HG
  • Pigment yellow ECY 210
  • Yellow ECY 210
  • Irgalite yellow B 3L
  • Sunbrite yellow 13
  • Symuler fast yellow 4306
  • Seikafast yellow 2600
  • Keystone jet print micro yellow
  • Sunbrite yellow 13-275-0049
  • Hostafine yellow GR
  • Vibracolor yellow PYE 13L
  • NSC 5336
  • Unisperse yellow BAW-PI
  • Discoall K 6820
  • Yellow BAW
  • Microlith yellow BAW-WA
  • 2,2′-[(3,3′-Dichloro[1,1′-biphenyl]-4,4′-diyl)bis(azo)]bis[N-(2,4-dimethylphenyl)-3-oxobutanamide
  • ZAY 452
  • Sunbrite yellow 13-275-0536
  • Sunbrite yellow 275-0536
  • Lionol yellow 1314
  • Flexiverse yellow YFD 1303
  • PY 13
  • Sunbright yellow 13
  • Permanent yellow 1148
  • Benzidine yellow 13
  • TCY 1305
  • C.I. Pigment yellow 13
  • Butanamide, 2,2′-[(3,3′-dichloro[1,1′-biphenyl]-4,4′-diyl)bis(azo)]bis[N-(2,4-dimethylphenyl)-3-oxo-
  • 2,2′-[(3,3′-Dichloro[1,1′-biphenyl]-4,4′-diyl)bis(2,1-diazenediyl)]bis[N-(2,4-dimethylphenyl)-3-oxobutanamide]
  • C.I. 21100
  • Benzidine yellow 20544
  • Benzidine yellow GE
  • Benzidine yellow GR
  • Benzidine yellow lemon 12221
  • Dainichi benzidine yellow 2GR
  • Elkon fast yellow GR
  • Helio fast yellow GRF
  • Helio fast yellow GRN
  • Hostaperm yellow GR
  • Irgalite yellow BAW
  • Irgalite yellow BAWX
  • Irgaplast yellow IRS
  • Isol benzidine fast yellow GRX
  • Isol Benzidine Fast Yellow GRX spec
  • Kromon yellow GXR
  • Latexol fast yellow JR
  • Light yellow JBR
  • Monolite fast yellow GLV
  • Monolite yellow GL
  • Monolite yellow GLA
  • Permanent yellow GR
  • Pigment yellow MH
  • Polymo yellow GR
  • Recolite fast yellow BLF
  • Recolite fast yellow BLT
  • Rubber fast yellow GRA
  • Sanyo light fast benzidine yellow R
  • Saranac yellow X 2838
  • Symuler fast yellow GRF
  • Tertropigment fast yellow VGR
  • Tertropigment PGR
  • Vulcan fast yellow GR
  • Vulcan fast yellow GRA
  • Vulcan fast yellow GRN
  • Vynamon yellow GRE
  • Yellow toner YB 5
  • Vynamon yellow GRES
  • Isol benzidene yellow GRX 2548
  • Diarylide yellow
  • Symuler fast yellow GRTF
  • Segnale light yellow GRX
  • Isol diaryl yellow GRF
  • Graphtol yellow RGS
  • Sico fast yellow D 1355
  • Permanent yellow GR 01
  • Lionol yellow FG 1310
  • KET Yellow 405
  • Disazo yellow
  • Sico fast yellow D 1351
  • Irgalite yellow LBIW
  • Irgalite yellow BKW
  • Lionol yellow SGR
  • Unisperse yellow BP-I
  • Irgalite yellow LBG
  • Irgalite yellow BGW

Work with Pigment yellow 13

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Similar compounds

Pigment yellow 17478952-72-491 % similar Pigment yellow 145468-75-780 % similar Pigment yellow 126358-85-668 % similar Pigment yellow 174531-49-164 % similar Pigment yellow 835567-15-764 % similar 4,4'-((3,3'-Dichloro(1,1'-biphenyl)-4,4'-diyl)bis(azo))bis(2,4-dihydro-5-methyl-2-(p-tolyl)-3H-pyrazol-3-one)15793-73-453 % similar Light yellow2512-29-049 % similar Pigment yellow 36486-23-347 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Elsewhere

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