Salbutamol

CAS Registry Number®

18559-94-9

CAS Name

Salbutamol

Molecular Formula

C13H21NO3

Molecular Mass

239.31

Cite this Page

Salbutamol.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=18559-94-9 (retrieved 2024-11-24) (CAS RN: 18559-94-9).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    151 °C

  • Density (2)

    1.0035 g/cm³

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C13H21NO3/c1-13(2,3)14-7-12(17)9-4-5-11(16)10(6-9)8-15/h4-6,12,14-17H,7-8H2,1-3H3

InChIKey

InChIKey=NDAUXUAQIAJITI-UHFFFAOYSA-N

SMILES

C(CNC(C)(C)C)(O)C1=CC(CO)=C(O)C=C1

Canonical SMILES

OC1=CC=C(C=C1CO)C(O)CNC(C)(C)C

Other Names for this Substance

  • 1,3-Benzenedimethanol, α1-[[(1,1-dimethylethyl)amino]methyl]-4-hydroxy-
  • m-Xylene-α,α′-diol, α1-[(tert-butylamino)methyl]-4-hydroxy-
  • α1-[[(1,1-Dimethylethyl)amino]methyl]-4-hydroxy-1,3-benzenedimethanol
  • α1-tert-Butylaminomethyl-4-hydroxy-m-xylene-α1,α3-diol
  • Salbutamol

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Deleted or Replaced CAS Registry Numbers

35763-26-9