chempirical

Tridecylbenzene

C19H32CAS 123-02-4260.46 g/mol

Open in Covalent MOL file

Properties

Molecular formula
C19H32
Molar mass
260.46 g/mol
Exact mass
260.2504 Da
Density
0.855 g/mL (at 25 °C)
Melting point
10 °C
Boiling point
346 °C
logP
6.54Crippen estimate
Polar surface area
0.0 Ų
H-bond donors / acceptors
0 / 0
Rotatable bonds
12

Identifiers

CAS number
123-02-4
SMILES
CCCCCCCCCCCCCc1ccccc1
InChIKey
MCVUKOYZUCWLQQ-UHFFFAOYSA-N
InChI
InChI=1S/C19H32/c1-2-3-4-5-6-7-8-9-10-11-13-16-19-17-14-12-15-18-19/h12,14-15,17-18H,2-11,13,16H2,1H3

Weigh it out

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

Names and synonyms

7 names
  • Benzene, tridecyl-
  • Tridecane, 1-phenyl-
  • Detergent alkylate no. 5
  • 1-Phenyltridecane
  • 1-Phenyl-n-tridecane
  • n-Tridecylbenzene
  • Tridecylbenzol

Work with Tridecylbenzene

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 n-Nonylbenzene1081-77-2100 % similar Dodecylbenzene123-01-3100 % 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

Androstane438-22-2

Elsewhere

PubChem CAS Common Chemistry NIST WebBook