chempirical

9-Bromoanthracene-D9

C14D9BrCAS 183486-02-4266.18 g/mol

Open in Covalent MOL file
DDBrDDDDDDD
Aryl halide

Properties

Molecular formula
C14D9Br
Molar mass
266.18 g/mol
Exact mass
265.0453 Da
logP
4.76Crippen estimate
Polar surface area
0.0 Ų
H-bond donors / acceptors
0 / 0
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
183486-02-4
SMILES
[2H]C1=C(C(=C2C(=C1[2H])C(=C3C(=C(C(=C(C3=C2Br)[2H])[2H])[2H])[2H])[2H])[2H])[2H]
InChIKey
ZIRVQSRSPDUEOJ-LOIXRAQWSA-N
InChI
InChI=1S/C14H9Br/c15-14-12-7-3-1-5-10(12)9-11-6-2-4-8-13(11)14/h1-9H/i1D,2D,3D,4D,5D,6D,7D,8D,9D

Weigh it out

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

Work with 9-Bromoanthracene-D9

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.

9-Bromoanthracene1564-64-3Unlabelled

Similar compounds

Anthracene-D101719-06-847 % similar (2H8)Naphthalene1146-65-237 % similar Bromobenzene-D54165-57-536 % similar

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

Same formula

9-Bromophenanthrene573-17-1 2-Bromophenanthrene62162-97-4 3-Bromophenanthrene715-50-4 2-Bromoanthracene7321-27-9

Elsewhere

PubChem CAS Common Chemistry NIST WebBook