chempirical

Biscresolfluorene

C27H22O2CAS 88938-12-9378.47 g/mol

Open in Covalent MOL file
HOHO
Phenol

Properties

Molecular formula
C27H22O2
Molar mass
378.47 g/mol
Exact mass
378.1620 Da
logP
6.08Crippen estimate
Polar surface area
40.5 Ų
H-bond donors / acceptors
2 / 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
88938-12-9
SMILES
CC1=C(C=CC(=C1)C2(C3=CC=CC=C3C4=CC=CC=C42)C5=CC(=C(C=C5)O)C)O
InChIKey
NUDSREQIJYWLRA-UHFFFAOYSA-N
InChI
InChI=1S/C27H22O2/c1-17-15-19(11-13-25(17)28)27(20-12-14-26(29)18(2)16-20)23-9-5-3-7-21(23)22-8-4-6-10-24(22)27/h3-16,28-29H,1-2H3

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Names and synonyms

1 names
  • 4,4'-(9H-Fluorene-9,9-diyl)bis(2-methylphenol)

Work with Biscresolfluorene

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-Bis(4-amino-3-methylphenyl)fluorene107934-60-162 % similar Bisphenol C79-97-054 % similar 4-tert-Butyl-2-methylphenol98-27-154 % similar 1,3-Dihydro-3,3-bis(4-hydroxy-3-methylphenyl)-2H-indol-2-one47465-97-452 % similar 9,9′-Bis(4-hydroxyphenyl)fluorene3236-71-351 % similar 6,6'-(9H-Fluoren-9-ylidene)bis(2-naphthalenol)934557-66-151 % similar Cresol red1733-12-651 % similar O-Cresolphthalein596-27-050 % similar

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

Elsewhere

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