chempirical

2,2′-[[1,1′-Binaphthalene]-2,2′-diylbis(oxy)]bis[ethanol]

C24H22O4CAS 55441-95-7374.44 g/mol

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HOOOHO
AlcoholEther

Properties

Molecular formula
C24H22O4
Molar mass
374.44 g/mol
Exact mass
374.1518 Da
Melting point
203–205.5 °C
logP
4.40Crippen estimate
Polar surface area
58.9 Ų
H-bond donors / acceptors
2 / 4
Rotatable bonds
7

Identifiers

CAS number
55441-95-7
SMILES
OCCOc1ccc2ccccc2c1-c1c(OCCO)ccc2ccccc12
InChIKey
OVJPYIRGUFWANT-UHFFFAOYSA-N
InChI
InChI=1S/C24H22O4/c25-13-15-27-21-11-9-17-5-1-3-7-19(17)23(21)24-20-8-4-2-6-18(20)10-12-22(24)28-16-14-26/h1-12,25-26H,13-16H2

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Names and synonyms

7 names
  • Ethanol, 2,2′-[[1,1′-binaphthalene]-2,2′-diylbis(oxy)]bis-
  • Ethanol, 2,2′-[[1,1′-binaphthalene]-2,2′-diylbis(oxy)]bis-, (±)-
  • 2,2′-Bis(2-hydroxyethoxy)-1,1′-binaphthalene
  • NSC 245024
  • TBIS-BNE
  • 1,1′-Bi[2-(2-hydroxyethoxy)naphthalene]
  • 2,2′-Bis(2-hydroxyethoxy)-1,1′-binaphthyl

Work with 2,2′-[[1,1′-Binaphthalene]-2,2′-diylbis(oxy)]bis[ethanol]

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-(2-Naphthoxy)ethanol93-20-950 % similar 2-(2-Chlorophenoxy)ethanol15480-00-947 % similar (±)-1,1′-Binaphthyl-2,2′-diyl hydrogen phosphate35193-63-646 % similar (+)-1,1′-Binaphthyl-2,2′-diyl hydrogen phosphate35193-64-746 % similar (-)-1,1′-Binaphthyl-2,2′-diyl hydrogen phosphate39648-67-446 % similar Phenoxyethanol122-99-645 % similar (13Br)-5,6-dihydro-5-(trans-4-propylcyclohexyl)-4H-dinaphtho[2,1-F:1′,2′-H][1,5]dioxonin944537-61-544 % similar 2-(2-Hydroxyethoxy)benzaldehyde22042-72-444 % similar

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

Same formula

P-Xylenolphthalein50984-88-8

Elsewhere

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