chempirical

γ-Phenylbenzenepropanol

C15H16OCAS 20017-67-8212.29 g/mol

Open in Covalent MOL file
HO
Alcohol

Properties

Molecular formula
C15H16O
Molar mass
212.29 g/mol
Exact mass
212.1201 Da
Melting point
20–22 °C
Boiling point
152–154 °C (at 0.3 Torr)
logP
3.20Crippen estimate
Polar surface area
20.2 Ų
H-bond donors / acceptors
1 / 1
Rotatable bonds
4

Hazards

Warning
Irritant (GHS07)

Aggregated from the ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P264, P270, P301+P317, P330, P501

Identifiers

CAS number
20017-67-8
SMILES
OCCC(c1ccccc1)c1ccccc1
InChIKey
IDCXQMVSIIJUEH-UHFFFAOYSA-N
InChI
InChI=1S/C15H16O/c16-12-11-15(13-7-3-1-4-8-13)14-9-5-2-6-10-14/h1-10,15-16H,11-12H2

Weigh it out

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

Names and synonyms

6 names
  • Benzenepropanol, γ-phenyl-
  • 1-Propanol, 3,3-diphenyl-
  • 3,3-Diphenyl-1-propanol
  • 3,3-Diphenylpropanol
  • NSC 74499
  • 3,3-Diphenylpropyl alcohol

Work with γ-Phenylbenzenepropanol

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 Isotope patternExact mass and the mass spectrum pattern

Similar compounds

γ-Aminobenzenepropanol14593-04-559 % similar (R)-3-Amino-3-phenylpropan-1-ol170564-98-459 % similar (S)-1-Phenyl-3-propanolamine82769-76-459 % similar 3,3-Diphenylpropyl bromide20017-68-954 % similar 3,3-Diphenylpropylamine5586-73-254 % similar 1,1-Diphenylpentane1726-12-150 % similar 2-Methoxy-5-methyl-γ-phenylbenzenepropanol124937-73-149 % similar 1,1'-Hexylidenebis(benzene)1530-04-748 % similar

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

Same formula

4-(4-N-Propylphenyl)phenol59748-39-9 4-Cumylphenol599-64-4 4,4'-Dimethylbenzhydrol885-77-8

Elsewhere

PubChem CAS Common Chemistry NIST WebBook