1,1′-Binaphthyl

C20H14CAS 604-53-5254.33 g/mol

Open in Covalent MOL file

Properties

Molecular formula
C20H14
Molar mass
254.33 g/mol
Exact mass
254.1096 Da
Density
1.3 g/mL
Melting point
160 °C
logP
5.66Crippen estimate
Polar surface area
0.0 Ų
H-bond donors / acceptors
0 / 0
Rotatable bonds
1

Hazards

Warning
Irritant (GHS07)

Aggregated from 39 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P264, P264+P265, P270, P273, P280, P301+P317, P305+P351+P338, P330, P337+P317, P501

Identifiers

CAS number
604-53-5
SMILES
c1ccc2c(-c3cccc4ccccc34)cccc2c1
InChIKey
ZDZHCHYQNPQSGG-UHFFFAOYSA-N
InChI
InChI=1S/C20H14/c1-3-11-17-15(7-1)9-5-13-19(17)20-14-6-10-16-8-2-4-12-18(16)20/h1-14H

Weigh it out

Type any one amount. The others follow from the molar mass and density.

Names and synonyms

9 names
  • 1,1'-Binaphthyl
  • 1,1′-Binaphthalene
  • α,α′-Binaphthyl
  • (±)Binaphthyl
  • (±)-1,1′-Binaphthyl
  • Racemic 1,1′-binaphthyl
  • NSC 15230
  • NSC 662279
  • 1-Naphthalen-1-ylnaphthalene

Work with 1,1′-Binaphthyl

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

9,10-Di(1-naphthyl)anthracene26979-27-174 % similar 1-Phenylnaphthalene605-02-770 % similar 9-(Naphthalen-1-yl)anthracene7424-70-664 % similar Phenanthrene85-01-859 % similar 2,5-Di(1-naphthyl)-1,3,4-oxadiazole905-62-458 % similar 4-(1-Naphthalenyl)benzenamine125404-00-456 % similar 1-(4-Bromophenyl)naphthalene204530-94-956 % similar 9-Bromo-10-(naphthalen-1-yl)anthracene400607-04-756 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

Triptycene477-75-8 9-Phenylanthracene602-55-1 2,2'-Binaphthalene612-78-2 9-Phenylphenanthrene844-20-2

Elsewhere

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