chempirical

Fluorene-9-acetic acid

C15H12O2CAS 6284-80-6224.26 g/mol

Open in Covalent MOL file
OHO
Carboxylic acid

Properties

Molecular formula
C15H12O2
Molar mass
224.26 g/mol
Exact mass
224.0837 Da
Melting point
138–139 °C
logP
3.27Crippen estimate
Polar surface area
37.3 Ų
H-bond donors / acceptors
1 / 1
Rotatable bonds
2

Identifiers

CAS number
6284-80-6
SMILES
O=C(O)CC1c2ccccc2-c2ccccc21
InChIKey
WFSMJMTYIMFHPV-UHFFFAOYSA-N
InChI
InChI=1S/C15H12O2/c16-15(17)9-14-12-7-3-1-5-10(12)11-6-2-4-8-13(11)14/h1-8,14H,9H2,(H,16,17)

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Names and synonyms

5 names
  • 9H-Fluorene-9-acetic acid
  • 9-Fluorenylacetic acid
  • NSC 5255
  • (9H-Fluoren-9-yl)acetic acid
  • 2-(9H-Fluoren-9-yl)acetic acid

Work with Fluorene-9-acetic acid

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

Diphenylpropionic acid606-83-761 % similar Fmoc-L-aspartic acid119062-05-455 % similar Fmoc-gly-oh29022-11-554 % similar 1-[(9H-Fluoren-9-ylmethoxy)carbonyl]-4-piperidineacetic acid180181-05-953 % similar β-Amino-2-chlorobenzenepropanoic acid68208-20-853 % similar 3-Phenylglutaric acid4165-96-252 % similar (1,2,3,4-Tetrahydro-isoquinolin-1-yl)-acetic acid105400-81-551 % similar (βR)-β-[[(9H-Fluoren-9-ylmethoxy)carbonyl]amino]benzenebutanoic acid209252-16-451 % similar

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

Same formula

Dibenzoylmethane120-46-7 2′-Hydroxychalcone1214-47-7 3-[1,1′-Biphenyl]-4-yl-2-propenoic acid13026-23-8 4-Hydroxychalcone20426-12-4 4′-Hydroxychalcone2657-25-2 Phenyl cinnamate2757-04-2 (±)-Flavanone487-26-3 Chalcone epoxide5411-12-1

Elsewhere

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