4-Butyl-1,1'-biphenyl

C₁₆H₁₈CAS 37909-95-8210.32 g/mol

Open in Covalent MOL file

Properties

Molecular formula: C₁₆H₁₈
Molar mass: 210.32 g/mol
Exact mass: 210.1409 Da
logP: 4.70Crippen estimate
Polar surface area: 0.0 Å²
H-bond donors / acceptors: 0 / 0
Rotatable bonds: 4

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

37909-95-8

SMILES

CCCCC1=CC=C(C=C1)C2=CC=CC=C2

InChIKey

JZDZRFNMDCBTNS-UHFFFAOYSA-N

InChI

InChI=1S/C16H18/c1-2-3-7-14-10-12-16(13-11-14)15-8-5-4-6-9-15/h4-6,8-13H,2-3,7H2,1H3

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Names and synonyms

1 names

4-Butylbiphenyl

Work with 4-Butyl-1,1'-biphenyl

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

4-Pentyl-1,1′-biphenyl7116-96-387 % similar 4-Hexyl-1,1′-biphenyl59662-31-683 % similar 4-Propylbiphenyl10289-45-978 % similar 4-Propyl-1,1'-biphenyl71294-42-378 % similar n-Butylbenzene104-51-873 % similar Pentylbenzene538-68-163 % similar 4′-Butyl-4-cyanobiphenyl52709-83-862 % similar 4-Methyl-4′-pentyl-1,1′-biphenyl64835-63-861 % similar

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

Same formula

4-tert-Butylbiphenyl1625-92-9 1,1-Di-p-tolylethane530-45-0 1,2-Bis(4-methylphenyl)ethane538-39-6

Elsewhere

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