2-Phenyl-2-propanol
Properties
- Molecular formula
- C9H12O
- Molar mass
- 136.19 g/mol
- Exact mass
- 136.0888 Da
- Density
- 0.9735 g/mL (at 20 °C)
- Melting point
- 36 °C
- Boiling point
- 202 °C
- logP
- 1.91Crippen estimate
- Polar surface area
- 20.2 Ų
- H-bond donors / acceptors
- 1 / 1
- Rotatable bonds
- 1
Identifiers
CAS number
617-94-7SMILES
CC(C)(O)c1ccccc1InChIKey
BDCFWIDZNLCTMF-UHFFFAOYSA-NInChI
InChI=1S/C9H12O/c1-9(2,10)8-6-4-3-5-7-8/h3-7,10H,1-2H3Weigh it out
Type any one amount. The others follow from the molar mass and density.
Names and synonyms
15 names · show all
- Benzenemethanol, α,α-dimethyl-
- Benzyl alcohol, α,α-dimethyl-
- α,α-Dimethylbenzenemethanol
- α-Cumyl alcohol
- α,α-Dimethylbenzyl alcohol
- 2-Propanol, 2-phenyl-
- Dimethylphenylcarbinol
- Dimethylphenylmethanol
- 1-Hydroxycumene
- 2-Phenylisopropanol
- Phenyldimethylcarbinol
- 1-Methyl-1-phenylethanol
- 2-Hydroxy-2-phenylpropane
- NSC 1261
- NSC 212537
Work with 2-Phenyl-2-propanol
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
α1,α1,α4,α4-Tetramethyl-1,4-benzenedimethanol2948-46-174 % similar
1,1-Diphenylethanol599-67-757 % similar
2,3-Dimethyl-2,3-diphenylbutane1889-67-450 % similar
Triphenylmethanol76-84-650 % similar
Dimethyldiphenylmethane778-22-350 % similar
(1-Chloro-1-methylethyl)benzene934-53-250 % similar
tert-Butylbenzene98-06-650 % similar
2-Phenyl-3-butyn-2-ol127-66-246 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds