chempirical

Dibenzofuran-D8

C12D8OCAS 93952-04-6176.24 g/mol

Open in Covalent MOL file
DDODDDDDD

Properties

Molecular formula
C12D8O
Molar mass
176.24 g/mol
Exact mass
176.1077 Da
logP
3.59Crippen estimate
Polar surface area
13.1 Ų
H-bond donors / acceptors
0 / 1
Rotatable bonds
0

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
93952-04-6
SMILES
[2H]C1=C(C(=C2C(=C1[2H])C3=C(C(=C(C(=C3O2)[2H])[2H])[2H])[2H])[2H])[2H]
InChIKey
TXCDCPKCNAJMEE-PGRXLJNUSA-N
InChI
InChI=1S/C12H8O/c1-3-7-11-9(5-1)10-6-2-4-8-12(10)13-11/h1-8H/i1D,2D,3D,4D,5D,6D,7D,8D

Weigh it out

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

Work with Dibenzofuran-D8

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

Stereoisomers, salts and isotopologues

The same compound in another form: other stereochemistry, a salt or hydrate, the free acid or base, or an isotope-labelled version.

Dibenzofuran132-64-9Unlabelled

Similar compounds

(1,2,3,4,5,6,7,8-2H8)-9H-Carbazole38537-24-533 % similar

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

Elsewhere

PubChem CAS Common Chemistry NIST WebBook