chempirical

2,7-Bibromospiro[fluorene-9,9'-xanthene]

C25H14Br2OCAS 198142-65-3490.19 g/mol

Open in Covalent MOL file
OBrBr
Aryl halideEther

Properties

Molecular formula
C25H14Br2O
Molar mass
490.19 g/mol
Exact mass
487.9411 Da
logP
7.68Crippen estimate
Polar surface area
9.2 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
198142-65-3
SMILES
C1=CC=C2C(=C1)C3(C4=CC=CC=C4O2)C5=C(C=CC(=C5)Br)C6=C3C=C(C=C6)Br
InChIKey
CYGGERDBQBUNDY-UHFFFAOYSA-N
InChI
InChI=1S/C25H14Br2O/c26-15-9-11-17-18-12-10-16(27)14-22(18)25(21(17)13-15)19-5-1-3-7-23(19)28-24-8-4-2-6-20(24)25/h1-14H

Weigh it out

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

Names and synonyms

1 names
  • 2,7-Dibromospiro[fluorene-9,9'-xanthene]

Work with 2,7-Bibromospiro[fluorene-9,9'-xanthene]

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

2-Bromospiro[fluorene-9,9'-xanthene]899422-06-194 % similar 2'-Bromo-spiro[9H-fluorene-9,9'-[9H]xanthene]1477458-14-282 % similar 3-Bromospiro[fluorene-9,9'-xanthene]1609484-28-776 % similar 2-Bromo-9,9′-spirobi[9H-fluorene]171408-76-771 % similar 2,7-Dibromo-9,9'-spiro-bifluorene171408-84-771 % similar 2,2'-Dibromo-9,9'-spirobifluorene67665-47-871 % similar 2,2',7,7'-Tetrabromo-9,9'-spirobi[9H-fluorene]128055-74-366 % similar 2-Bromo-9,9-dimethyl-9H-xanthene1565868-91-859 % similar

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

Elsewhere

PubChem CAS Common Chemistry NIST WebBook