chempirical

Acid black 194

C20H12N3NaO7SCAS 61931-02-0461.38 g/mol

Open in Covalent MOL file
NNHOSOOO−N+OO−OHNa+
AzoNitroPhenolSulfonic acid

Properties

Molecular formula
C20H12N3NaO7S
Molar mass
461.38 g/mol
Exact mass
461.0294 Da
logP
1.64Crippen estimate
Polar surface area
165.5 Ų
H-bond donors / acceptors
2 / 9
Rotatable bonds
4

Hazards

Environmental Hazard (GHS09)

Aggregated from 114 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P273, P391, P501

Identifiers

CAS number
61931-02-0
SMILES
C1=CC=C2C(=C1)C=CC(=C2N=NC3=C4C=CC(=CC4=C(C=C3O)S(=O)(=O)[O-])[N+](=O)[O-])O.[Na+]
InChIKey
DXRWYIKGBIPGAG-UHFFFAOYSA-M
InChI
InChI=1S/C20H13N3O7S.Na/c24-16-8-5-11-3-1-2-4-13(11)19(16)21-22-20-14-7-6-12(23(26)27)9-15(14)18(10-17(20)25)31(28,29)30;/h1-10,24-25H,(H,28,29,30);/q;+1/p-1

Weigh it out

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

Names and synonyms

56 names · show all
  • C.I. Acid black 194
  • Acidol black M-SRL
  • Telon fast black LD
  • Gryfalan black RL
  • Luganil black SL
  • Lanasyn black S-DL
  • Neutrilan black M-RC
  • Acidol black M
  • Nylosan black FWLN
  • Lederos S 2K
  • Neutrilan black M-RX
  • Dinacid black MSRL
  • Simacid black 24929
  • Rybanyl black RN
  • Coriamine fast black S-RL
  • Libacid black
  • Kenamide black KD2R
  • Dermacid black MSR
  • Acid black S-BL
  • Vilmanyl fast black S-RL
  • Magra black MR
  • Navidol black MSRL
  • Ambilan black DRL
  • Lederos S-2 black R
  • Cromoxyl black WB
  • Stelane black SR
  • Cololan black MRL
  • Ratna acid black MRL
  • Koroset black R
  • Acid black MSRL
  • Solcorom black PMR
  • Eurolana black SR
  • Allilon acid black WA
  • Airedale fast black
  • Kemacid black MSRL
  • Dynacid black an
  • Fabrilan black N-R
  • Acid black M-5RL
  • Triasolan black DR
  • Borulan black BL
  • Monacid black MSRL
  • Roven S-2 black R
  • Naphthazine black DSRL
  • Pacid black MSRL
  • Rathidol black M-SRL
  • Indacid black MSRL
  • Dyalan black S-DR
  • Polan black BL
  • Acid black RM
  • Colorosacid black 194
  • Victalan black M5RL
  • Rifa acid fast black S-RL
  • Triolan black SR
  • Sipolan black SRC
  • Vicoacid black H5RL
  • Black M-RX

Work with Acid black 194

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

Eriochrome black T1787-61-782 % similar C.I. Mordant black 172538-85-474 % similar Fast orange3468-63-159 % similar Para red6410-10-259 % similar C.I. Acid red 9710169-02-558 % similar Acid red 881658-56-657 % similar Pigment red 42814-77-957 % similar Hydroxynaphthol blue63451-35-457 % similar

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

Elsewhere

PubChem CAS Common Chemistry NIST WebBook