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Benproperine phosphate Structure

Benproperine phosphate

Chemical Properties

Melting point 150-152°
storage temp.  Refrigerator
solubility  DMSO (Slightly, Heated), Methanol (Slightly)
form  Solid
color  White to Off-White
InChI InChI=1S/C21H27NO.H3O4P/c1-18(22-14-8-3-9-15-22)17-23-21-13-7-6-12-20(21)16-19-10-4-2-5-11-19;1-5(2,3)4/h2,4-7,10-13,18H,3,8-9,14-17H2,1H3;(H3,1,2,3,4)
InChIKey MCVUURBOSHQXMK-UHFFFAOYSA-N
SMILES C1(C=CC=CC=1OCC(C)N1CCCCC1)CC1=CC=CC=C1.P(=O)(O)(O)O
CAS DataBase Reference 19428-14-9(CAS DataBase Reference)

Safety Information

Toxicity LD50 orally in mice: 1431 mg/kg (Tellini, De Fina)

Usage And Synthesis

Preparation Products And Raw materials

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