chempirical

Anthrone

C14H10OCAS 90-44-8194.23 g/mol

Open in Covalent MOL file
O
Ketone

Properties

Molecular formula
C14H10O
Molar mass
194.23 g/mol
Exact mass
194.0732 Da
Melting point
155 °C
Boiling point
375.2 °C
logP
2.82Crippen estimate
Polar surface area
17.1 Ų
H-bond donors / acceptors
0 / 1
Rotatable bonds
0

Hazards

Warning
Irritant (GHS07)

Aggregated from 51 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, P501

Identifiers

CAS number
90-44-8
SMILES
O=C1c2ccccc2Cc2ccccc21
InChIKey
RJGDLRCDCYRQOQ-UHFFFAOYSA-N
InChI
InChI=1S/C14H10O/c15-14-12-7-3-1-5-10(12)9-11-6-2-4-8-13(11)14/h1-8H,9H2

Weigh it out

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

Names and synonyms

6 names
  • 9(10H)-Anthracenone
  • Anthracene, 9,10-dihydro-9-oxo-
  • Carbothrone
  • 9-Oxoanthracene
  • NSC 1965
  • Quino power ATR

Reactions

Work with Anthrone

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 Boiling point under vacuumAt any pressure, from its normal boiling point Isotope patternExact mass and the mass spectrum pattern

Similar compounds

Dibenzosuberone1210-35-174 % similar Anthraquinone84-65-162 % similar Dibenz[B,E]oxepin-11(6H)-one4504-87-459 % similar Dibenzo[B,E]thiepin-11(6H)-one1531-77-757 % similar Bianthrone434-85-554 % similar Fluorenone486-25-954 % similar Phthalide87-41-248 % similar 2,2′-Dihydroxybenzophenone835-11-048 % similar

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

Same formula

Fluorene-2-carboxaldehyde30084-90-3 Diphenylketene525-06-4

Elsewhere

PubChem CAS Common Chemistry NIST WebBook Wikipedia