chempirical

Violanthrone

C34H16O2CAS 116-71-2456.50 g/mol

Open in Covalent MOL file
OO
Ketone

Properties

Molecular formula
C34H16O2
Molar mass
456.50 g/mol
Exact mass
456.1150 Da
Melting point
338–339 °C
Water solubility
< 1 g/L (18.9 °C)
logP
8.16Crippen estimate
Polar surface area
34.1 Ų
H-bond donors / acceptors
0 / 2
Rotatable bonds
0

Hazards

Not classified as hazardous under GHS by 25 ECHA notifiers. Aggregated from 25 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Identifiers

CAS number
116-71-2
SMILES
O=C1c2ccccc2-c2ccc3c4ccc5c6c(ccc(c7ccc1c2c73)c64)C(=O)c1ccccc1-5
InChIKey
YKSGNOMLAIJTLT-UHFFFAOYSA-N
InChI
InChI=1S/C34H16O2/c35-33-25-7-3-1-5-17(25)19-9-11-21-22-12-10-20-18-6-2-4-8-26(18)34(36)28-16-14-24(30(22)32(20)28)23-13-15-27(33)31(19)29(21)23/h1-16H

Weigh it out

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

Names and synonyms

80 names · show all
  • Anthra[9,1,2-cde]benzo[rst]pentaphene-5,10-dione
  • C.I. 59800
  • Ahcovat dark blue BO
  • Amanthrene dark blue BO
  • Amanthrene supra dark blue BO
  • Anthravat dark blue BO
  • Belanthrene dark blue BO
  • Benzadone dark blue BOA
  • Benzadone dark blue BOR
  • Benzadone dark blue BORI
  • Benzadone navy blue R
  • Bianthrone A
  • Calcoloid dark blue B 2R
  • Calcoloid dark blue BO
  • Calcoloid dark blue BOD
  • Caledon dark blue BM
  • Caledon printing dark blue BM
  • Carbanthrene dark blue DR
  • Carbanthrene printing dark blue DR
  • Cibanone dark blue BO
  • Cibanone dark blue FBOA
  • Cibanone dark blue FMBA
  • Cibanone dark blue MBA
  • Dibenzanthrone
  • Endurol dark blue BOR
  • Fenanthren dark blue BO
  • Hydroform deep blue BOA
  • Indanthren dark blue BOA
  • Indanthrene dark blue BO
  • Irgalite blue 2R
  • Leucosol dark blue BR
  • Mikethrene dark blue BO
  • Mikethrene dark blue BOA
  • Navinon dark blue BO
  • Nihonthrene dark blue BO
  • Nihonthrene dark blue BOA
  • Nyanthrene navy blue BR
  • Palanthrene dark blue BOA
  • Paradone dark blue
  • Paradone dark blue 58321
  • Pernithrene dark blue BOA
  • Ponsol dark blue BR
  • Ponsol dark blue BRD
  • Romantrene dark blue FBO
  • Sandothrene dark blue NBM
  • Sandothrene dark blue NBO
  • Sandothrene dark blue NBOA
  • Sandothrene dark blue NMBA
  • Solanthrene dark blue B
  • Solanthrene dark blue BA
  • Tinon dark blue BO
  • Tinon dark blue BOA
  • Tinon dark blue BOR
  • Tinon dark blue MB
  • Tinon dark blue MBA
  • Tyrian dark blue I-BOA
  • C.I. Vat blue 20
  • Violanthrone A
  • 5,10-Violanthrenedione
  • Dinaphtho[1,2,3-cd:3′,2′,1′-lm]perylene-5,10-dione
  • Mikethrene dark blue B
  • Sandothrene dark blue BOA
  • Vat blue 20
  • Solanthrene dark blue F-BA
  • Vat dark blue O
  • C.I. Pigment blue 65
  • Pigment blue 65
  • Farbanthren dark blue BOA
  • Solanthrene dark blue BOA
  • Ostanthren dark blue BOA
  • Cibanone dark blue BOA
  • Violanthrene N
  • Caledon navy BM
  • Indanthren dark blue DB
  • Indanthrene dark blue DB
  • Vat blue BO
  • NSC 2212
  • Navinon blue BO
  • Cibanone navy blue 01
  • Anthra(9,1,2-cde)benzo(rst)pentaphene-5,10-dione

Work with Violanthrone

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

Fluorenone486-25-965 % similar Benzanthrone82-05-365 % similar 16,17-Dihydroxyanthra[9,1,2-cde]benzo[rst]pentaphene-5,10-dione128-59-664 % similar Pyranthrone128-70-164 % similar Vat green 1128-58-559 % similar Dibromodibenzo[b,def]chrysene-7,14-dione1324-11-459 % similar 3-Bromobenzanthrone81-96-958 % similar 3-Bromo-9H-fluoren-9-one2041-19-251 % similar

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

Same formula

Isoviolanthrone128-64-3

Elsewhere

PubChem CAS Common Chemistry NIST WebBook Wikipedia