chempirical

C.I. Direct blue 86

C32H14CuN8Na2O6S2CAS 1330-38-7780.16 g/mol

Open in Covalent MOL file
NNNN−NSOOO−NNN−SOOO−Na+Na+Cu2+
Sulfonic acid

Properties

Molecular formula
C32H14CuN8Na2O6S2
Molar mass
780.16 g/mol
Exact mass
778.9569 Da
logP
-2.06Crippen estimate
Polar surface area
219.9 Ų
H-bond donors / acceptors
0 / 12
Rotatable bonds
2

Identifiers

CAS number
1330-38-7
SMILES
C1=CC=C2C(=C1)C3=NC4=NC(=NC5=C6C=CC=CC6=C([N-]5)N=C7C8=C(C=C(C=C8)S(=O)(=O)[O-])C(=N7)N=C2[N-]3)C9=C4C=CC(=C9)S(=O)(=O)[O-].[Na+].[Na+].[Cu+2]
InChIKey
LSASILAMYYWGBH-UHFFFAOYSA-L
InChI
InChI=1S/C32H16N8O6S2.Cu.2Na/c41-47(42,43)15-9-11-21-23(13-15)32-38-28-20-8-4-2-6-18(20)26(34-28)36-30-22-12-10-16(48(44,45)46)14-24(22)31(40-30)37-27-19-7-3-1-5-17(19)25(33-27)35-29(21)39-32;;;/h1-14H,(H2-2,33,34,35,36,37,38,39,40,41,42,43,44,45,46);;;/q-2;+2;2*+1/p-2

Weigh it out

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

Names and synonyms

121 names · show all
  • Cuprate(2-), [29H,31H-phthalocyanine-C,C-disulfonato(4-)-κN29,κN30,κN31,κN32]-, sodium (1:2)
  • Copper, [dihydrogen phthalocyaninedisulfonato(2-)]-, disodium salt
  • Cuprate(2-), [29H,31H-phthalocyanine-C,C-disulfonato(4-)-N29,N30,N31,N32]-, disodium
  • Cuprate(2-), [29H,31H-phthalocyanine-C,C-disulfonato(4-)-κN29,κN30,κN31,κN32]-, disodium
  • 29H,31H-Phthalocyanine-C,C-disulfonic acid, copper complex
  • C.I. 74180
  • Aizen primula turquoise blue GL
  • Aizen primula turquoise blue GLH
  • Amanil fast turquoise LB
  • Arlazol fast turquoise blue 6GN
  • Atlantic fast turquoise LGA
  • Belamine fast turquoise LGL
  • Calcodur turquoise GL
  • Chlorantine fast turquoise blue GLL
  • Chlorantine fast turquoise VLL
  • Chrome leather turquoise blue GLL
  • Cuprofix blue green B
  • Cuprofix blue green FB
  • Cuprofix turquoise blue FBL
  • Daivougen blue BF
  • Derma fast turquoise W 2GL
  • Diaphtamine light turquoise G
  • Diazol light turquoise JL
  • Direct blue 86
  • Direct light turquoise blue GL
  • Durazol blue 8G
  • Durazol paper blue 8G
  • Durazol blue 8GA
  • Eliamina light turquoise G
  • Eliamina light turquoise GL
  • Fastusol turquoise blue LGA
  • Fenaluz turquoise G
  • Finisol blue green G
  • Heliogen blue SBL
  • Heliogen blue SBLA
  • Helion turquoise blue FGLL
  • Helion turquoise blue GLL
  • Hiltamine turquoise blue 8GL
  • Hispaluz turquoise GE
  • Interchem direct fast turquoise GLRC
  • Kayarus turquoise blue GL
  • Kiwa turquoise blue GL
  • Light fast turquoise blue G
  • Lurantin light turquoise blue GL
  • Lurantin light turquoise blue GLD
  • Nankai brilliant fast blue G
  • Nyanza fast turquoise GL
  • Pheno fast turquoise GL
  • Pontamine fast turquoise 8GL
  • Saturn turquoise blue LG
  • Solamine light turquoise blue GL
  • Solantine turquoise G
  • Solar turquoise blue GLL
  • Solius light turquoise blue GL
  • Solophenyl turquoise blue GL
  • Solophenyl turquoise blue GTL
  • Solophenyl turquoise blue GTL extra
  • Sumilight supra turquoise blue G
  • Sumilight supra turquoise blue FB
  • Symulon direct turquoise blue B
  • Tertrodirect fast turquoise GL
  • Tetramine fast D extra green
  • Toyo cupro cyanine blue GL
  • Triantine fast turquoise GL
  • Triantine light turquoise blue GL
  • Tricufix turquoise blue 2GL
  • Turquoise 8GL
  • Turquoise GLL
  • Direct lightfast turquoise
  • Lightfast turquoise
  • Direct fast turquoise
  • Durazol fast blue 8GS
  • Direct fast blue L 7V
  • Direct lightfast turquoise M
  • Solophenyl turquoise blue GL supra
  • Pergasol turquoise blue GAL supra
  • Amafast turquoise 8GGL
  • Intralite turquoise GLL
  • Amanil fast turquoise
  • Paliofast blue SBL
  • Paper fast turquoise GP
  • Sirius supra turquoise blue GL
  • Durazol blue 8GS
  • Orbantin turquoise blue GL
  • Sirius light turquoise blue GL
  • C.I. Acid blue 87
  • Acid blue 87
  • Intrabond liquid turquoise LL
  • Special fast turquoise 8GL
  • Sirius supra turquoise blue Z-BGL
  • Fastogen blue SBL
  • Pergasol turquoise G
  • Direct fast turquoise blue GL
  • Direct light turquoise GL
  • Direct turquoise blue GL
  • Vali fast blue 1605
  • Neptune blue 722
  • Luxol fast blue MBSN
  • Luxol fast blue MBS
  • C.I. Solvent blue 38
  • Solvent blue 38
  • Lampronol fast turquoise J
  • Methasol fast blue 2B
  • Methasol fast blue 2BX
  • Nyastral blue SS
  • Spirit soluble fast blue 6GHV
  • Disulfo copper phthalocyanine amine salt
  • Direct emerald blue GL
  • Direct lightfast emerald blue GL
  • Direct lightfast turquoise GL
  • Direct lightfast blue green GL
  • Sumilight supra turquoise blue G conc.
  • Iragon blue DBL 86
  • Cibafix direct blue 86
  • Direct sun green blue GL
  • Basacid blue 752
  • Sepisol fast blue MBSN
  • Direct fast turquoise GL
  • Direct lightfast turquoise blue GL
  • Sirius turquoise GL
  • Kayaset cyan J 301

Work with C.I. Direct blue 86

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

BM 64147-14-850 % similar Zinc phthalocyanine14320-04-842 % similar Sodium 2-naphthalenesulfonate532-02-542 % similar Iron(II) phthalocyanine132-16-141 % similar Cobalt phthalocyanine3317-67-741 % similar Disodium m-benzenedisulfonate831-59-440 % similar Disodium 2,6-naphthalenedisulfonate1655-45-439 % similar Aluminum phthalocyanine chloride14154-42-839 % similar

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

Elsewhere

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