chempirical

2,2',7,7'-Tetrabromo-9,9'-spirobi[9H-fluorene]

C25H12Br4CAS 128055-74-3631.99 g/mol

Open in Covalent MOL file
BrBrBrBr
Aryl halide

Properties

Molecular formula
C25H12Br4
Molar mass
631.99 g/mol
Exact mass
627.7673 Da
logP
9.08Crippen estimate
Polar surface area
0.0 Ų
H-bond donors / acceptors
0 / 0
Rotatable bonds
0

Identifiers

CAS number
128055-74-3
SMILES
C1=CC2=C(C=C1Br)C3(C4=C2C=CC(=C4)Br)C5=C(C=CC(=C5)Br)C6=C3C=C(C=C6)Br
InChIKey
MASXXNUEJVMYML-UHFFFAOYSA-N
InChI
InChI=1S/C25H12Br4/c26-13-1-5-17-18-6-2-14(27)10-22(18)25(21(17)9-13)23-11-15(28)3-7-19(23)20-8-4-16(29)12-24(20)25/h1-12H

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Names and synonyms

1 names
  • 2,2',7,7'-Tetrabromo-9,9'-spirobifluorene

Work with 2,2',7,7'-Tetrabromo-9,9'-spirobi[9H-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′-spirobi[9H-fluorene]171408-76-779 % similar 2,7-Dibromo-9,9-difluorofluorene1229603-71-764 % similar 2,7-Dibromo-9,9-dimethylfluorene28320-32-364 % similar 2,7-Dibromo-9-phenyl-9H-fluoren-9-ol132717-37-452 % similar 2-Bromo-11,11-dimethyl-11H-benzo[B]fluorene1198396-39-250 % similar (7-Bromo-9,9-dimethyl-9H-fluoren-2-yl)boronic Acid (contains varying amounts of Anhydride)1213768-48-946 % similar 9,9-Bis(4-bromophenyl)fluorene128406-10-045 % similar 1,4-Dibromo-2-(trifluoromethyl)benzene7657-09-245 % similar

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

Elsewhere

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