chempirical

Phenylalaninol

C9H13NOCAS 16088-07-6151.21 g/mol

Open in Covalent MOL file
H2NHO
AlcoholPrimary Amine

Properties

Molecular formula
C9H13NO
Molar mass
151.21 g/mol
Exact mass
151.0997 Da
Melting point
128 °C
Boiling point
150–160 °C
logP
0.55Crippen estimate
Polar surface area
46.3 Ų
H-bond donors / acceptors
2 / 2
Rotatable bonds
3

Identifiers

CAS number
16088-07-6
SMILES
NC(CO)Cc1ccccc1
InChIKey
STVVMTBJNDTZBF-UHFFFAOYSA-N
InChI
InChI=1S/C9H13NO/c10-9(7-11)6-8-4-2-1-3-5-8/h1-5,9,11H,6-7,10H2

Weigh it out

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

Names and synonyms

16 names · show all
  • Benzenepropanol, β-amino-
  • 1-Propanol, 2-amino-3-phenyl-
  • β-Aminobenzenepropanol
  • 3-Phenyl-2-aminopropanol
  • 2-Amino-3-phenyl-1-propanol
  • 2-Amino-1-hydroxy-3-phenylpropane
  • (±)-Phenylalaninol
  • (±)-2-Amino-3-phenylpropanol
  • (±)-2-Amino-3-phenyl-1-propanol
  • (RS)-2-Amino-3-phenylpropanol
  • DL-Phenylalaninol
  • (RS)-2-Amino-3-phenyl-1-propanol
  • NSC 20899
  • 2-Amino-3-phenylpropan-1-ol
  • 2-Amino-3-phenylpropanol
  • 2-Amino-3-phenyl-1-propanediol

Work with Phenylalaninol

Predict the NMR spectrum1H and 13C shifts with multiplicities 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

Same formula

Benzylethanolamine104-63-2 3-Ethylamino-P-cresol120-37-6 γ-Aminobenzenepropanol14593-04-5 3-Methoxyphenethylamine2039-67-0 2-Methoxyphenethylamine2045-79-6 (+)-1-(4-Methoxyphenyl)ethylamine22038-86-4 3-(Dimethylamino)benzenemethanol23501-93-1 2-Butoxypyridine27361-16-6

Elsewhere

PubChem CAS Common Chemistry NIST WebBook