chempirical

2,7-Diacetylfluorene

C17H14O2CAS 961-27-3250.30 g/mol

Open in Covalent MOL file
OO
Ketone

Properties

Molecular formula
C17H14O2
Molar mass
250.30 g/mol
Exact mass
250.0994 Da
logP
3.66Crippen estimate
Polar surface area
34.1 Ų
H-bond donors / acceptors
0 / 2
Rotatable bonds
2

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
961-27-3
SMILES
CC(=O)C1=CC2=C(C=C1)C3=C(C2)C=C(C=C3)C(=O)C
InChIKey
RIRYGERFWHUZBT-UHFFFAOYSA-N
InChI
InChI=1S/C17H14O2/c1-10(18)12-3-5-16-14(7-12)9-15-8-13(11(2)19)4-6-17(15)16/h3-8H,9H2,1-2H3

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Names and synonyms

1 names
  • 1,1'-(9H-Fluorene-2,7-diyl)di(ethan-1-one)

Work with 2,7-Diacetylfluorene

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-Acetyl-9H-fluorene781-73-783 % similar 6-Acetyltetralin774-55-059 % similar 1,4-Diacetylbenzene1009-61-654 % similar 1-(2,3-Dihydro-5-benzofuranyl)ethanone90843-31-553 % similar 1,3-Diacetylbenzene6781-42-652 % similar 1-[3-(Chloromethyl)-4-hydroxyphenyl]ethanone24085-05-051 % similar 5-Acetyl-2,3-dihydro-1H-indol-2-one64483-69-851 % similar 3,4-Dimethylacetophenone3637-01-250 % similar

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

Elsewhere

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