chempirical

1,1-Di-p-tolylethane

C16H18CAS 530-45-0210.32 g/mol

Open in Covalent MOL file

Properties

Molecular formula
C16H18
Molar mass
210.32 g/mol
Exact mass
210.1409 Da
logP
4.46Crippen estimate
Polar surface area
0.0 Ų
H-bond donors / acceptors
0 / 0
Rotatable bonds
2

Identifiers

CAS number
530-45-0
SMILES
CC1=CC=C(C=C1)C(C)C2=CC=C(C=C2)C
InChIKey
IDONYCOFOUUWLB-UHFFFAOYSA-N
InChI
InChI=1S/C16H18/c1-12-4-8-15(9-5-12)14(3)16-10-6-13(2)7-11-16/h4-11,14H,1-3H3

Weigh it out

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

Names and synonyms

6 names
  • 1-Methyl-4-[1-(4-methylphenyl)ethyl]benzene
  • 1-Methyl-4-(1-(4-methylphenyl)ethyl)benzene
  • Alpha,alpha-di-p-tolylethane
  • Bis(p-tolyl)ethane
  • 1-Methyl-4-[1-(p-tolyl)-ethyl]-benzene
  • 1,1'-(Ethane-1,1-diyl)bis(4-methylbenzene)

Work with 1,1-Di-p-tolylethane

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

P-Cymene99-87-662 % similar (-)-1-(4-Methylphenyl)ethylamine27298-98-254 % similar (+)-1-(4-Methylphenyl)ethylamine4187-38-654 % similar 1-(4-Methylphenyl)ethanol536-50-554 % similar P-Xylene106-42-353 % similar 1,1-Diphenylethane612-00-052 % similar (Cymene)ruthenium dichloride dimer52462-29-048 % similar Tri-P-tolylphosphine1038-95-545 % similar

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

Same formula

1,2-Bis(4-methylphenyl)ethane538-39-6

Elsewhere

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