chempirical

Solvent yellow 21

C34H27CrN8O62+CAS 5601-29-6695.64 g/mol

Open in Covalent MOL file
N−NONNOHON−NONHN+OHOCr3+
AzoCarboxylic acid

Properties

Molecular formula
C34H27CrN8O62+
Molar mass
695.64 g/mol
Exact mass
695.1459 Da
logP
4.51Crippen estimate
Polar surface area
197.8 Ų
H-bond donors / acceptors
3 / 7
Rotatable bonds
8

Identifiers

CAS number
5601-29-6
SMILES
Cc1[n-]n(-c2ccccc2)c(=O)c1N=Nc1ccccc1C(=O)O.Cc1[n-]n(-c2ccccc2)c(=O)c1N=[NH+]c1ccccc1C(=O)O.[Cr+3]
InChIKey
IHWYTZCAOLKLQM-UHFFFAOYSA-M
InChI
InChI=1S/2C17H13N4O3.Cr/c2*1-11-15(16(22)21(20-11)12-7-3-2-4-8-12)19-18-14-10-6-5-9-13(14)17(23)24;/h2*2-10H,1H3,(H,23,24);/q2*-1;+3/p-1

Weigh it out

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

Names and synonyms

73 names · show all
  • Chromate(1-), bis[2-[2-[4,5-dihydro-3-methyl-5-(oxo-κO)-1-phenyl-1H-pyrazol-4-yl]diazenyl-κN1]benzoato(2-)-κO]-, hydrogen (1:1)
  • Chromate(1-), bis[2-[(4,5-dihydro-3-methyl-5-oxo-1-phenyl-1H-pyrazol-4-yl)azo]benzoato(2-)]-, hydrogen
  • Chromium, bis[o-[(5-hydroxy-3-methyl-1-phenylpyrazol-4-yl)azo]benzoato]-
  • Chromate(1-), bis[2-[[4,5-dihydro-3-methyl-5-(oxo-κO)-1-phenyl-1H-pyrazol-4-yl]azo-κN1]benzoato(2-)-κO]-, hydrogen
  • Benzoic acid, 2-[(4,5-dihydro-3-methyl-5-oxo-1-phenyl-1H-pyrazol-4-yl)azo]-, chromium complex
  • Fenaplex yellow NR
  • Neutralan yellow G
  • Neutrichrome yellow JRL
  • Orasol yellow GRLN
  • Supralan yellow NR
  • Zapon fast yellow R
  • C.I. Solvent yellow 21
  • Vali fast yellow 3107
  • Vali fast yellow 3105
  • Stenolana yellow MR
  • C.I. Acid yellow 121
  • Lampronol light yellow 2RN
  • C.I. Acid yellow 161
  • Kayakalan yellow GL
  • C.I. Acid yellow 59
  • Coranil fast yellow G
  • Lanyl yellow GG
  • Remalan fast yellow G
  • Isolan yellow GLS
  • Ortolan yellow G
  • Endanil yellow JR
  • Ostalan yellow 2GL
  • Acid yellow 59
  • Acid yellow 121
  • Acid yellow 161
  • Lanasyn yellow 2GLN
  • C.I. Acid yellow 162
  • Lanafast yellow GL
  • Acid yellow 162
  • C.I. Acid yellow 129
  • Cibalan yellow 2GL
  • Lanasyn yellow 2GW
  • Acid yellow 129
  • C.I. Acid yellow 171
  • Irgalan yellow 2GL
  • Amichrome light yellow 2RL
  • C.I. Acid yellow 118
  • Vialon fast yellow GL
  • Vialon fast yellow G
  • Oleosol fast yellow 2G
  • Acid yellow 171
  • Acid yellow 118
  • Valiosol yellow 4120T
  • Solcorom yellow P
  • Kayakalan yellow GL 143
  • Oleosol yellow 2G
  • Lanyl yellow GS
  • Filamid yellow R
  • Irgalan yellow 2GL-KWL
  • Tirasol yellow
  • Yellow J 12
  • Trialan yellow GLN
  • Taigalan yellow 2GL
  • Neutrilan yellow S-GR
  • Ostalan yellow F 2GL
  • Trialan yellow 2GL
  • Covanyl yellow SLW
  • Navitan yellow 2GLN
  • Vicoacid yellow 59
  • Eukesolar yellow GL
  • Acid yellow 2GLN
  • Navilan yellow 2GLN
  • Relon yellow 7R
  • Solvent yellow BL
  • Y 20
  • Solvent yelow 21
  • Vali fast yellow 3120
  • Oracet YW 160

Work with Solvent yellow 21

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

Amichrome light orange RL52256-37-855 % similar 2-(4′-Hydroxyphenylazo)benzoic acid1634-82-835 % similar Methyl red493-52-735 % similar N-Acetylanthranilic acid89-52-133 % similar 2-[2-[4-(Dipropylamino)phenyl]diazenyl]benzoic acid2641-01-232 % similar 2-Acetoacetylaminobenzoic acid35354-86-032 % similar

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

Elsewhere

PubChem CAS Common Chemistry NIST WebBook