2-Bromo-9,9-dihexyl fluorene

C₂₅H₃₃BrCAS 226070-05-9413.44 g/mol

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Properties

Molecular formula: C₂₅H₃₃Br
Molar mass: 413.44 g/mol
Exact mass: 412.1766 Da
logP: 8.66Crippen estimate
Polar surface area: 0.0 Å²
H-bond donors / acceptors: 0 / 0
Rotatable bonds: 10

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

226070-05-9

SMILES

CCCCCCC1(C2=CC=CC=C2C3=C1C=C(C=C3)Br)CCCCCC

InChIKey

NNYSRQDAPSNOKV-UHFFFAOYSA-N

InChI

InChI=1S/C25H33Br/c1-3-5-7-11-17-25(18-12-8-6-4-2)23-14-10-9-13-21(23)22-16-15-20(26)19-24(22)25/h9-10,13-16,19H,3-8,11-12,17-18H2,1-2H3

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Names and synonyms

1 names

2-Bromo-9,9-dihexylfluorene

Work with 2-Bromo-9,9-dihexyl fluorene

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-Bromo-9,9-di-n-octylfluorene302554-80-9100 % similar 2-Bromo-9,9-di-N-butylfluoren88223-35-289 % similar 2,7-Dibromo-9,9-didecylfluorene175922-78-886 % similar 9,9-Dihexyl-2,7-dibromofluorene189367-54-286 % similar 9,9-Dioctyl-2,7-dibromofluorene198964-46-486 % similar 2-Bromo-9,9-diethylfluorene287493-15-665 % similar 9,9-Dihexyl-9H-fluoren-2-boronic acid371193-08-763 % similar 2-(9,9-Dioctyl-9H-fluoren-2-yl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane302554-81-058 % similar

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

Elsewhere

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