chempirical

1,3,5-Triisopropylbenzene

C15H24CAS 717-74-8204.36 g/mol

Open in Covalent MOL file

Properties

Molecular formula
C15H24
Molar mass
204.36 g/mol
Exact mass
204.1878 Da
Density
0.8547 g/mL (at 20 °C)
Melting point
−7.4 °C
Boiling point
238 °C
logP
5.06Crippen estimate
Polar surface area
0.0 Ų
H-bond donors / acceptors
0 / 0
Rotatable bonds
3

Identifiers

CAS number
717-74-8
SMILES
CC(C)c1cc(C(C)C)cc(C(C)C)c1
InChIKey
VUMCUSHVMYIRMB-UHFFFAOYSA-N
InChI
InChI=1S/C15H24/c1-10(2)13-7-14(11(3)4)9-15(8-13)12(5)6/h7-12H,1-6H3

Weigh it out

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

Names and synonyms

8 names
  • Benzene, 1,3,5-tris(1-methylethyl)-
  • Benzene, 1,3,5-triisopropyl-
  • 1,3,5-Tris(1-methylethyl)benzene
  • 2,4,6-Triisopropylbenzene
  • 1,3,5-Tris(isopropyl)benzene
  • NSC 403075
  • 1,3,5-Tri(propan-2-yl)benzene
  • 1,3,5-Tris(propan-2-yl)benzene

Work with 1,3,5-Triisopropylbenzene

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

1,4-Diisopropylbenzene100-18-560 % similar 2,6-Diisopropylnaphthalene24157-81-153 % similar Cumene98-82-850 % similar 2,6-Dibromo-4-(1-methylethyl)benzenamine10546-65-348 % similar 3-Isopropyl-5-methylphenol3228-03-346 % similar 4-Isopropylpyridine696-30-045 % similar P-Cymene99-87-645 % similar 2-Isopropylnaphthalene2027-17-043 % similar

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

Same formula

n-Nonylbenzene1081-77-2 (-)-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

Elsewhere

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