chempirical

Acid blue 113

C32H21N5Na2O6S2CAS 3351-05-1681.65 g/mol

Open in Covalent MOL file
O−SOONNNNNHSO−OONa+Na+
AzoSecondary amineSulfonic acid

Properties

Molecular formula
C32H21N5Na2O6S2
Molar mass
681.65 g/mol
Exact mass
681.0729 Da
logP
8.30Crippen estimate
Polar surface area
170.2 Ų
H-bond donors / acceptors
3 / 9
Rotatable bonds
8

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
3351-05-1
SMILES
[O-]S(=O)(=O)c1cccc(N=Nc2ccc(N=Nc3ccc(Nc4ccccc4)c4c3cccc4S([O-])(=O)=O)c3ccccc23)c1.[Na+].[Na+]
InChI

The InChI we hold for this record describes the parent acid and the metal separately rather than the salt above, so it is not shown here.

Weigh it out

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

Names and synonyms

143 names · show all
  • 1-Naphthalenesulfonic acid, 8-(phenylamino)-5-[2-[4-[2-(3-sulfophenyl)diazenyl]-1-naphthalenyl]diazenyl]-, sodium salt (1:2)
  • C.I. Acid blue 113
  • C.I. Acid Blue 113, disodium salt
  • 1-Naphthalenesulfonic acid, 8-(phenylamino)-5-[[4-[(3-sulfophenyl)azo]-1-naphthalenyl]azo]-, disodium salt
  • C.I. 26360
  • Acid fast blue 5R
  • Acid leather blue 5RN
  • Acid leather blue RN
  • Acid milling navy blue 2RNX
  • Alphanol blue 5RN
  • Azo cyanine blue 5R extra
  • Benzyl fast blue 5R
  • Cirene blue 5RA
  • Cloth blue 5R
  • Cloth fast blue R
  • Cloth fast blue S 5R
  • Cloth fast blue RN
  • Colacid fast blue 5R
  • Coomassie navy blue 2RN
  • Cyanine navy blue 2RNX
  • Cyanine navy blue 5R
  • Eniacid cloth blue 5R
  • Erio fast blue S 5R
  • Erionyl blue S 5R
  • Eriosin fast blue S 5R
  • Fast blue 5R
  • Fenazo blue S 5R
  • Folan fast navy blue 5R
  • Hispacid cloth blue 5RF
  • Java fast blue 5R
  • Kayanol cyanine 5R
  • Kayanol milling cyanine 5R
  • Milling fast blue 5R
  • Naphthalene leather navy 2RN
  • Neutral blue 5R
  • Neutral fast blue 5R
  • Nylomine acid navy C 2R
  • Nylomine acid navy P 2R
  • Optanol Cyanine 5R extra
  • Pontacyl fast blue 5R
  • Sulfon blue 5R
  • Sulfonine blue 5R
  • Sulphoncin blue 5R
  • Sulphon cyanine 5RA-CF
  • Sulphoncyanine 5R extra
  • Sulphonol navy 5RX
  • Suminol Cyanine 5R extra
  • Supranol fast cyanin 5R
  • Supranol fast cyanine 5R extra
  • Supranol fast cyanine 5RT extra
  • Telon fast navy blue R
  • Tertracid fast navy blue CR
  • Vondamol fast blue 5R
  • Wool fast blue 5R
  • Wool fast navy blue 5R
  • Yamada acid cyanine 5R
  • Suminol milling cyanine 5R extra
  • Nylosan navy N-RE
  • Amacid fast navy 5R
  • Levanol fast cyanine 5RN
  • Suminol milling cyanine 5R
  • Polan navy blue R
  • Atul acid cyanine blue 5R
  • Supranol fast cyanine 5R
  • Everacid milling cyanine 5R
  • Supranol navy R
  • Erionyl navy blue 2RN
  • Nylosan navy N-RBL
  • Sulfone cyanin 5R
  • Intrazone fast blue 5RS
  • Erionyl navy R
  • Rifa acid cyanine 5R
  • Navitan fast blue S 5R
  • Acid cyanine 5R
  • Acid cyanine blue 5R
  • Acid blue 5R
  • Pacid navy blue 2RNX
  • Triacid sulfon blue 5R
  • Rifa acid navy blue BN
  • Milling navy blue 2RNX
  • Rifa leather navy blue 2RN
  • Simacid navy blue 24914
  • Anadurm navy M-5RX
  • Triacid milling navy blue 5RN
  • Acid milling navy blue S 5R
  • Apollo acid cyanine 5R
  • Fabracid navy blue M-SR
  • Concorde acid cyanine M 5R
  • Acid blue for leather
  • Acid dark blue for polyamide
  • Cyanine 5R
  • Daedo acid navy blue BNC
  • Sulfocyanine blue 5R
  • Ranocid fast blue S 5R
  • Ambinyl cyanine M 5R
  • Dycosweak acid navy blue 5R
  • Erionyl navy A-R
  • Follone blue 5R
  • Dinacid navy blue 2RNS
  • Multicuer blue 5R
  • Formo blue 5R
  • Conacid blue AAC
  • Kemacid blue 2RNX
  • Victacid blue 5R
  • Covanyl navy 2R
  • Lecotan navy blue 2R
  • Acid navy blue 2BN
  • Acid navy blue 5R
  • Covalene navy 2R
  • Dermacid blue LN
  • Libacid navy blue L 2RNX
  • Acid navy blue 2RNX
  • Vicoacid blue 113
  • Everacid navy 2RN
  • Acid navy blue 2RHX
  • Colorosacid blue 113
  • Indacid milling navy blue S 5R
  • Telon supra navy blue RN
  • Vopsider blue N-A 5RL
  • Best acid milling cyanine 5R
  • Eniacid blue 5R
  • Rybanyl navy NL 5R
  • Colocid fast navy blue 5R
  • Concorde leather blue 5R
  • Acid fast blue N 5R
  • Sella fast navy C-R
  • Monacid navy blue 2RNX
  • Nylosan navy N-RBLA
  • Vopsider blue A 5RL
  • Tracid cyanine 5R
  • Kenamide navy K 2R
  • Midlon blue 5RG
  • Acid blue S 5R
  • Kenanthrol navy 2R
  • Telon navy AMF
  • Nanhacid navy N-RBL
  • Everacid cyanine N 5R
  • Acid dark blue 2G
  • Navy blue 5R
  • Nylosan navy N-BL
  • Navy N-BL
  • Navy N-RBL
  • Leather cadet blue RB

Work with Acid blue 113

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

Metanil yellow587-98-461 % similar 8-Anilino-1-naphthalenesulfonate magnesium salt18108-68-448 % similar Acid orange 5554-73-448 % similar Acid orange 20523-44-446 % similar Azorubine3567-69-944 % similar Amaranth (dye)915-67-343 % similar Ponceau 4R2611-82-743 % similar Sodium diphenylamine-4-sulfonate6152-67-643 % similar

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

Elsewhere

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