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4-Benzyl Albuterol Structure

4-Benzyl Albuterol

  • Product Name4-Benzyl Albuterol
  • CAS56796-66-8
  • CBNumberCB1924082
  • MFC20H27NO3
  • MW329.43
  • EINECS260-385-8
  • MDL NumberMFCD00026273
  • MOL File56796-66-8.mol

Chemical Properties

Boiling point: 510.1±50.0 °C(Predicted)
Density  1.120±0.06 g/cm3(Predicted)
storage temp.  2-8°C
solubility  DMSO: Sparingly soluble: 1-10 mg/ml
Ethanol: Slightly soluble: 0.1-1 mg/ml
pka 13.97±0.20(Predicted)
Major Application pharmaceutical small molecule
InChI InChI=1S/C20H27NO3/c1-20(2,3)21-12-18(23)16-9-10-19(17(11-16)13-22)24-14-15-7-5-4-6-8-15/h4-11,18,21-23H,12-14H2,1-3H3
InChIKey ICDQPCBDGAHBGG-UHFFFAOYSA-N
SMILES C1(OCC2C=CC=CC=2)=CC=C(C(O)CNC(C)(C)C)C=C1CO

Safety

Symbol(GHS)  Exclamation Mark (GHS07)
Signal word  Warning
Hazard statements  H302-H315
Precautionary statements  P264-P270-P280-P301+P312+P330-P332+P313-P501
HS Code  2922509090
REACH Registrations Active

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