chempirical

Quinizarine green ss

C28H22N2O2CAS 128-80-3418.50 g/mol

Open in Covalent MOL file
NHNHOO
KetoneSecondary amine

Properties

Molecular formula
C28H22N2O2
Molar mass
418.50 g/mol
Exact mass
418.1681 Da
Density
0.45 g/mL
Melting point
218 °C
logP
6.57Crippen estimate
Polar surface area
58.2 Ų
H-bond donors / acceptors
2 / 4
Rotatable bonds
4

Hazards

Not classified as hazardous under GHS by 2,913 ECHA notifiers. Aggregated from 2,913 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Identifiers

CAS number
128-80-3
SMILES
Cc1ccc(Nc2ccc(Nc3ccc(C)cc3)c3c2C(=O)c2ccccc2C3=O)cc1
InChIKey
TVRGPOFMYCMNRB-UHFFFAOYSA-N
InChI
InChI=1S/C28H22N2O2/c1-17-7-11-19(12-8-17)29-23-15-16-24(30-20-13-9-18(2)10-14-20)26-25(23)27(31)21-5-3-4-6-22(21)28(26)32/h3-16,29-30H,1-2H3

Weigh it out

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

Names and synonyms

68 names · show all
  • Mitsui PS green B
  • Q 0021
  • Macrolex green 5B gran
  • 9,10-Anthracenedione, 1,4-bis[(4-methylphenyl)amino]-
  • Anthraquinone, 1,4-di-p-toluidino-
  • 1,4-Bis[(4-methylphenyl)amino]-9,10-anthracenedione
  • 11091 Green
  • C.I. 61565
  • Ahcoquinone cyanine green base
  • Alizarine cyanine green base
  • Alizarine cyanine green G fat soluble
  • Alizarine green G base
  • Anthraquinone green G base
  • Arlosol green B
  • Arlosol green BS
  • Arlosol green BSS
  • C.I. Solvent green 3
  • 1,4-Di-p-toluidinoanthraquinone
  • Nitro fast green GB
  • Organol fast green J
  • Quinizarine green base
  • Quinizarin green SS
  • Sudan green 4B
  • Toyo oriental oil blue G
  • Waxoline green G
  • D And C green no. 6
  • Amaplast green OZ
  • Solvent green 3
  • Fat soluble anthraquinone green
  • Organol green J
  • Quinazarin green
  • C-Green 10
  • Green no. 202
  • 1,4-Bis-p-toluidino-9,10-anthraquinone
  • Fat soluble green anthraquinone
  • Macrolex green 5B
  • Cyanine Green G base
  • Sumiplast green G
  • Oil green 530
  • Orient oil green 530
  • 1,4-Bis[(4-methylphenyl)amino]anthraquinone
  • FD and C Green no. 6
  • C.I. Disperse green 6:1
  • 1,4-Bis(4′-methylanilino)anthraquinone
  • Diaresin green C
  • Ceres green BB
  • Nitro fast green GSB
  • Kayaset green A-B
  • Oil green 5602
  • 1,4-Bis(p-tolylamino)anthraquinone
  • Oplas green 533
  • Japan green 202
  • D 4
  • D 4 (Dye)
  • D&C Green no. 6
  • Sandoplast green GSB
  • 1,4-Di-(4′-toluidino)anthraquinone
  • NSC 84207
  • Waxoline green 6GFW
  • Green 6
  • Brown 921
  • DC Green 6
  • KP plast green G
  • Transparent green 5B
  • 1,4-Bis(4-methylanilino)anthracene-9,10-dione
  • Solvaperm green GSB
  • 1,4-Bis(p-tolylamino)anthracene-9,10-dione
  • Parasol green 5B

Work with Quinizarine green ss

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

Solvent blue 104116-75-663 % similar 1,4-Bis[(2,6-diethyl-4-methylphenyl)amino]-9,10-anthracenedione32724-62-258 % similar Solvent red 5281-39-056 % similar Disperse blue 142475-44-756 % similar Acid green 254403-90-154 % similar N-[4-[(9,10-Dihydro-4-hydroxy-9,10-dioxo-1-anthracenyl)amino]phenyl]acetamide67905-17-353 % similar Dianthrimide82-22-451 % similar Oil blue A14233-37-551 % similar

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

Elsewhere

PubChem CAS Common Chemistry NIST WebBook Wikipedia