chempirical

4-Isopropylphenol

C9H12OCAS 99-89-8136.19 g/mol

Open in Covalent MOL file
OH
Phenol

Properties

Molecular formula
C9H12O
Molar mass
136.19 g/mol
Exact mass
136.0888 Da
Density
0.97 g/mL (at 15 °C)
Melting point
62.3 °C
Boiling point
230 °C
logP
2.52Crippen estimate
Polar surface area
20.2 Ų
H-bond donors / acceptors
1 / 1
Rotatable bonds
1

Identifiers

CAS number
99-89-8
SMILES
CC(C)c1ccc(O)cc1
InChIKey
YQUQWHNMBPIWGK-UHFFFAOYSA-N
InChI
InChI=1S/C9H12O/c1-7(2)8-3-5-9(10)6-4-8/h3-7,10H,1-2H3

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Names and synonyms

8 names
  • Phenol, 4-(1-methylethyl)-
  • Phenol, p-isopropyl-
  • 4-(1-Methylethyl)phenol
  • p-Isopropylphenol
  • Australol
  • p-Cumenol
  • NSC 1888
  • 4-(Propan-2-yl)phenol

Work with 4-Isopropylphenol

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-Diisopropylbenzene100-18-567 % similar 1-(4-Hydroxyphenyl)ethanol2380-91-858 % similar 4,4′,4′′-Methylidynetris[phenol]603-44-157 % similar 1-Bromo-4-isopropylbenzene586-61-857 % similar 3-Isopropylphenol618-45-154 % similar P-Cymene99-87-652 % similar 4-sec-Butylphenol99-71-852 % similar Hydroquinone123-31-950 % similar

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

Same formula

2,6-Dimethylanisole1004-66-6 2-Phenyl-1-propanol1123-85-9 Benzenepropanol122-97-4 2,3-Dimethylbenzenemethanol13651-14-4 1-Phenyl-2-propanol14898-87-4 1-Ethyl-4-methoxybenzene1515-95-3 (S)-1-Phenyl-2-propanol1517-68-6 (+)-1-Phenyl-1-propanol1565-74-8

Elsewhere

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