chempirical

2-Isopropylnaphthalene

C13H14CAS 2027-17-0170.25 g/mol

Open in Covalent MOL file

Properties

Molecular formula
C13H14
Molar mass
170.25 g/mol
Exact mass
170.1096 Da
Density
0.9753 g/mL (at 20 °C)
Melting point
14.5 °C
Boiling point
268.2 °C
logP
3.96Crippen estimate
Polar surface area
0.0 Ų
H-bond donors / acceptors
0 / 0
Rotatable bonds
1

Identifiers

CAS number
2027-17-0
SMILES
CC(C)c1ccc2ccccc2c1
InChIKey
TVYVQNHYIHAJTD-UHFFFAOYSA-N
InChI
InChI=1S/C13H14/c1-10(2)12-8-7-11-5-3-4-6-13(11)9-12/h3-10H,1-2H3

Weigh it out

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

Names and synonyms

8 names
  • Naphthalene, 2-(1-methylethyl)-
  • Naphthalene, 2-isopropyl-
  • 2-(1-Methylethyl)naphthalene
  • β-Isopropylnaphthalene
  • NSC 166466
  • 6-Isopropylnaphthalene
  • 2-(Propan-2-yl)naphthalene
  • 2-Propan-2-ylnaphthalene

Work with 2-Isopropylnaphthalene

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

2,6-Diisopropylnaphthalene24157-81-181 % similar (-)-1-(2-Naphthyl)ethylamine3082-62-061 % similar 1-(2-Naphthyl)ethanol40295-80-561 % similar 1-(2-Naphthyl)ethanol7228-47-961 % similar 6-Isopropylquinoline135-79-555 % similar 1,3-Diisopropylbenzene99-62-754 % similar 1,4-Diisopropylbenzene100-18-550 % similar Retene483-65-850 % similar

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

Same formula

2,3,5-Trimethylnaphthalene2245-38-7 4,6,8-Trimethylazulene941-81-1

Elsewhere

PubChem CAS Common Chemistry NIST WebBook