chempirical

C.I. Acid yellow 44

C34H30N6Na2O10S2CAS 2429-76-7792.75 g/mol

Open in Covalent MOL file
ONNSO−OONNOOHNSO−OOONHNa+Na+
AzoKetoneSulfonic acid

Properties

Molecular formula
C34H30N6Na2O10S2
Molar mass
792.75 g/mol
Exact mass
792.1260 Da
logP
6.36Crippen estimate
Polar surface area
257.5 Ų
H-bond donors / acceptors
4 / 12
Rotatable bonds
13

Identifiers

CAS number
2429-76-7
SMILES
CC(=O)C(N=Nc1cc(S([O-])(=O)=O)c(-c2cc(C)c(N=NC(C(C)=O)C(=O)Nc3ccccc3)cc2S([O-])(=O)=O)cc1C)C(=O)Nc1ccccc1.[Na+].[Na+]
InChIKey
PZXXEYOHLWMJPW-UHFFFAOYSA-N
InChI
InChI=1S/C34H32N6O10S2.2Na/c1-19-15-25(29(51(45,46)47)17-27(19)37-39-31(21(3)41)33(43)35-23-11-7-5-8-12-23)26-16-20(2)28(18-30(26)52(48,49)50)38-40-32(22(4)42)34(44)36-24-13-9-6-10-14-24;;/h5-18,31-32H,1-4H3,(H,35,43)(H,36,44)(H,45,46,47)(H,48,49,50);;

Weigh it out

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

Names and synonyms

36 names · show all
  • [1,1′-Biphenyl]-2,2′-disulfonic acid, 5,5′-dimethyl-4,4′-bis[2-[2-oxo-1-[(phenylamino)carbonyl]propyl]diazenyl]-, sodium salt (1:2)
  • C.I. Acid Yellow 44, disodium salt
  • [1,1′-Biphenyl]-2,2′-disulfonic acid, 5,5′-dimethyl-4,4′-bis[[2-oxo-1-[(phenylamino)carbonyl]propyl]azo]-, disodium salt
  • Milling yellow 6G
  • C.I. 23900
  • Amacid milling yellow 5G
  • Azo milling yellow 3G
  • Belacid milling yellow 5G
  • Benzyl yellow 8G
  • Brilliant milling yellow 6G
  • Brilliant yellow 6G
  • Coomassie yellow 7G
  • Diacid milling yellow H 5G
  • Fenafor yellow F 5G
  • Folan yellow 7G
  • Milling fast yellow 5G
  • Milling yellow H 5G
  • Milling yellow 7JL
  • Milling yellow H 5GA-CF
  • Milling yellow NGS
  • Optanol yellow 5G
  • Peeracid milling yellow 6G
  • Suminol milling brilliant yellow 5G
  • Sumitomo milling yellow H 5G
  • Tertracid milling yellow H 5G
  • Vondamol fast yellow H 5G
  • Xylene milling yellow 6G
  • Milling yellow NGS 1828
  • Sandolan milling yellow N 6G
  • Acid milling yellow 6G
  • Acid brilliant yellow 6G
  • Acid yellow 6G
  • Conacid yellow DD
  • Triacid fast yellow 6G
  • Best acid milling yellow 7GS
  • Dycosweak acid brilliant yellow 6G

Work with C.I. Acid yellow 44

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

Direct yellow 810130-29-754 % similar Pigment yellow 16871832-85-445 % similar Scarlet gn4548-53-241 % similar Direct red 233441-14-337 % similar Light yellow2512-29-035 % similar Acid blue 406424-85-735 % similar Red 2G3734-67-635 % similar Pigment yellow 191129423-54-734 % similar

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

Elsewhere

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