(S)-(-)-Propranolol hydrochloride | SBID = 185 | Compound | Pubchem logo

Struc Structure

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Molecular Properties

Interactions: 3
PubChem TPSA/Å2: 41.5
Ertl TPSA/Å2:
Hydrophilicity (PubChem XLogP):
Hydrophilicity (Cheng XLogP3):
Charge: 0.0
Number of H-Bond Donors: 3.0
Number of H-Bond Acceptors: 3.0
Number of Stereogenic Bonds (E/Z): 0.0
Number of Stereogenic Atoms (R/S): 1.0
3D Volume/Å3:
Sum Formula: C16H22ClNO2
M / g/mol: 295.807
Complexity: 257.0
Number of Conformers: 0.0

Identifiers

  • Tags: aromatic, typical guest, drug
  • Name: (S)-(-)-Propranolol hydrochloride
  • Preferred Abbreviation: (S)-Propranolol hydrochloride
  • IUPAC Name: (2S)-1-naphthalen-1-yloxy-3-(propan-2-ylamino)propan-2-ol;hydrochloride
  • CAS: 4199-10-4
  • CID: 165193
  • InChiKey: ZMRUPTIKESYGQW-UQKRIMTDSA-N
  • InChi: InChI=1S/C16H21NO2.ClH/c1-12(2)17-10-14(18)11-19-16-9-5-7-13-6-3-4-8-15(13)16;/h3-9,12,14,17-18H,10-11H2,1-2H3;1H/t14-;/m0./s1
  • CanoSmiles: CC(C)NCC(COC1=CC=CC2=CC=CC=C21)O.Cl
  • IsoSmiles: CC(C)NC[C@@H](COC1=CC=CC2=CC=CC=C21)O.Cl