(+)-1-Phenyl-1-propanol

C9H12OCAS 1565-74-8136.19 g/mol

Open in Covalent MOL file
HO
Alcohol

Properties

Molecular formula
C9H12O
Molar mass
136.19 g/mol
Exact mass
136.0888 Da
Boiling point
104 °C (at 15 Torr)
logP
2.13Crippen estimate
Polar surface area
20.2 Ų
H-bond donors / acceptors
1 / 1
Rotatable bonds
2
Stereocentres
Rin SMILES atom order

Hazards

Warning
Irritant (GHS07)

Aggregated from 44 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P264, P270, P301+P317, P330, P501

Identifiers

CAS number
1565-74-8
SMILES
CC[C@@H](O)c1ccccc1
InChIKey
DYUQAZSOFZSPHD-SECBINFHSA-N
InChI
InChI=1S/C9H12O/c1-2-9(10)8-6-4-3-5-7-8/h3-7,9-10H,2H2,1H3/t9-/m1/s1

Weigh it out

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

Names and synonyms

19 names · show all
  • Benzenemethanol, α-ethyl-, (αR)-
  • Benzyl alcohol, α-ethyl-, (+)-
  • Benzenemethanol, α-ethyl-, (R)-
  • (αR)-α-Ethylbenzenemethanol
  • (+)-1-Phenylpropyl alcohol
  • (R)-(+)-α-Hydroxypropylbenzene
  • (R)-(+)-1-Phenyl-1-propanol
  • (R)-(+)-α-Ethylbenzenemethanol
  • (+)-α-Ethylbenzyl alcohol
  • (R)-Phenylethylcarbinol
  • (R)-α-Ethylbenzyl alcohol
  • (R)-1-Phenyl-1-propanol
  • (R)-α-Hydroxypropylbenzene
  • (R)-1-Phenylpropanol
  • (+)-α-Phenylpropanol
  • (+)-1-Phenylpropanol
  • (R)-α-Ethylbenzenemethanol
  • (+)-(αR)-α-Ethylbenzenemethanol
  • (1R)-1-Phenylpropan-1-ol

Work with (+)-1-Phenyl-1-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 Isotope patternExact mass and the mass spectrum pattern

Stereoisomers, salts and isotopologues

The same compound in another form: other stereochemistry, a salt or hydrate, the free acid or base, or an isotope-labelled version.

(S)-1-Phenylpropanol613-87-6Enantiomer 1-Phenyl-1-propanol93-54-9Stereo not defined

Similar compounds

1-Phenyl-1-pentanol583-03-959 % similar (1R)-(-)-1-Phenylethane-1,2-diol16355-00-358 % similar (S)-(+)-1-Phenyl-1,2-ethanediol25779-13-958 % similar 1-Phenyl-1,2-ethanediol7138-28-558 % similar 1-Phenyl-1,2-ethanediol93-56-158 % similar (1-Ethylpropyl)benzene1196-58-356 % similar 1,1-Diphenylpropane1530-03-656 % similar (-)-Phenylethanolamine2549-14-656 % 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 (R)-1-Phenyl-2-propanol1572-95-8

Elsewhere

PubChem CAS Common Chemistry NIST WebBook