2-Bromo-9,9-dimethyl-9H-xanthene

C₁₅H₁₃BrOCAS 1565868-91-8289.17 g/mol

Open in Covalent MOL file

Aryl halide Ether

Properties

Molecular formula: C₁₅H₁₃BrO
Molar mass: 289.17 g/mol
Exact mass: 288.0150 Da
logP: 4.88Crippen estimate
Polar surface area: 9.2 Å²
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

1565868-91-8

SMILES

CC1(C2=CC=CC=C2OC3=C1C=C(C=C3)Br)C

InChIKey

QCPNMPAEAGVMFA-UHFFFAOYSA-N

InChI

InChI=1S/C15H13BrO/c1-15(2)11-5-3-4-6-13(11)17-14-8-7-10(16)9-12(14)15/h3-9H,1-2H3

Weigh it out

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

Work with 2-Bromo-9,9-dimethyl-9H-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

9,9-Dimethyl-9H-xanthene19814-75-667 % similar 2'-Bromo-spiro[9H-fluorene-9,9'-[9H]xanthene]1477458-14-261 % similar 2,7-Bibromospiro[fluorene-9,9'-xanthene]198142-65-359 % similar 2-Bromo-9,9-dimethylfluorene28320-31-258 % similar 2-Bromospiro[fluorene-9,9'-xanthene]899422-06-156 % similar 3-Bromo-9,9-dimethylfluorene1190360-23-654 % similar 2,7-Dibromo-9,9-dimethylfluorene28320-32-353 % similar 3-Bromospiro[fluorene-9,9'-xanthene]1609484-28-753 % similar

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

Elsewhere

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