4-Phenyl-2-butanol
Properties
- Molecular formula
- C10H14O
- Molar mass
- 150.22 g/mol
- Exact mass
- 150.1045 Da
- Density
- 0.9899 g/mL (at 1 °C)
- Melting point
- 61 °C
- Boiling point
- 239 °C
- logP
- 2.00Crippen estimate
- Polar surface area
- 20.2 Ų
- H-bond donors / acceptors
- 1 / 1
- Rotatable bonds
- 3
Identifiers
CAS number
2344-70-9SMILES
CC(O)CCc1ccccc1InChIKey
GDWRKZLROIFUML-UHFFFAOYSA-NInChI
InChI=1S/C10H14O/c1-9(11)7-8-10-5-3-2-4-6-10/h2-6,9,11H,7-8H2,1H3Weigh it out
Type any one amount. The others follow from the molar mass and density.
Names and synonyms
10 names
- Benzenepropanol, α-methyl-
- 2-Butanol, 4-phenyl-
- α-Methylbenzenepropanol
- 1-Phenyl-3-butanol
- 1-Methyl-3-phenyl-1-propanol
- 2-Hydroxy-4-phenylbutane
- (±)-4-Phenylbutan-2-ol
- NSC 69076
- (±)-3-Phenyl-1-methylpropanol
- (3-Hydroxybutyl)benzene
Work with 4-Phenyl-2-butanol
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-Phenyl-2-propanol14898-87-465 % similar
(S)-1-Phenyl-2-propanol1517-68-665 % similar
1-Phenyl-2-propanol698-87-365 % similar
Isopentylbenzene2049-94-758 % similar
1-Methyl-3-phenylpropylamine22148-77-252 % similar
1-Methyl-3-phenylpropylamine22374-89-652 % similar
1-Phenoxy-2-propanol770-35-448 % similar
2,5-Hexanediol2935-44-648 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds