chempirical

n-Nonylbenzene

C15H24CAS 1081-77-2204.36 g/mol

Open in Covalent MOL file

Properties

Molecular formula
C15H24
Molar mass
204.36 g/mol
Exact mass
204.1878 Da
Density
0.8636 g/mL (at 20 °C)
Melting point
−24 °C
Boiling point
280.5 °C
logP
4.98Crippen estimate
Polar surface area
0.0 Ų
H-bond donors / acceptors
0 / 0
Rotatable bonds
8

Identifiers

CAS number
1081-77-2
SMILES
CCCCCCCCCc1ccccc1
InChIKey
LIXVMPBOGDCSRM-UHFFFAOYSA-N
InChI
InChI=1S/C15H24/c1-2-3-4-5-6-7-9-12-15-13-10-8-11-14-15/h8,10-11,13-14H,2-7,9,12H2,1H3

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

Names and synonyms

5 names
  • Benzene, nonyl-
  • Nonane, 1-phenyl-
  • Nonylbenzene
  • 1-Phenylnonane
  • 1-Nonylbenzene

Work with n-Nonylbenzene

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 Boiling point under vacuumAt any pressure, from its normal boiling point Isotope patternExact mass and the mass spectrum pattern

Similar compounds

Decylbenzene104-72-3100 % similar Hexylbenzene1077-16-3100 % similar Heptylbenzene1078-71-3100 % similar Dodecylbenzene123-01-3100 % similar Tridecylbenzene123-02-4100 % similar Hexadecylbenzene1459-09-2100 % similar Tetradecylbenzene1459-10-5100 % similar Heptadecylbenzene14752-75-1100 % similar

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

Same formula

(-)-Isolongifolene1135-66-6 3,5-Di-tert-butyltoluene15181-11-0 β-Farnesene18794-84-8 (-)-Cedrene469-61-4 Longifolene475-20-7 γ-Bisabolene495-62-5 (-)-β-Elemene515-13-9 Humulene6753-98-6

Elsewhere

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