4-N-Nonylbiphenyl

C₂₁H₂₈CAS 93972-01-1280.46 g/mol

Open in Covalent MOL file

Properties

Molecular formula: C₂₁H₂₈
Molar mass: 280.46 g/mol
Exact mass: 280.2191 Da
logP: 6.65Crippen estimate
Polar surface area: 0.0 Å²
H-bond donors / acceptors: 0 / 0
Rotatable bonds: 9

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

93972-01-1

SMILES

CCCCCCCCCC1=CC=C(C=C1)C2=CC=CC=C2

InChIKey

XMYSGVNXYKACMA-UHFFFAOYSA-N

InChI

InChI=1S/C21H28/c1-2-3-4-5-6-7-9-12-19-15-17-21(18-16-19)20-13-10-8-11-14-20/h8,10-11,13-18H,2-7,9,12H2,1H3

Weigh it out

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

Names and synonyms

1 names

1,1'-Biphenyl, nonyl-

Work with 4-N-Nonylbiphenyl

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-Hexyl-1,1′-biphenyl59662-31-6100 % similar 4-Pentyl-1,1′-biphenyl7116-96-396 % similar 4-Butyl-1,1'-biphenyl37909-95-883 % similar Decylbenzene104-72-375 % similar Hexylbenzene1077-16-375 % similar Heptylbenzene1078-71-375 % similar n-Nonylbenzene1081-77-275 % similar Dodecylbenzene123-01-375 % similar

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

Same formula

4,4'-Di-tert-butyldiphenylmethane19099-48-0

Elsewhere

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