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158681-13-1

Name Rimonabant hydrochloride
CAS 158681-13-1
EINECS(EC#) 233-720-0
Molecular Formula C22H21Cl3N4O
MDL Number MFCD04034714
Molecular Weight 463.79
MOL File 158681-13-1.mol

Chemical Properties

Appearance White to Off-White Crystalline Solid
Melting point  230-240°C
storage temp.  2-8°C
solubility  DMSO: soluble20mg/mL, clear
form  powder
color  white to beige
Usage The first of a new class of selective (Cannabinoid-1 (CB-1) receptor antagonists
InChI 1S/C22H21Cl3N4O.ClH/c1-14-20(22(30)27-28-11-3-2-4-12-28)26-29(19-10-9-17(24)13-18(19)25)21(14)15-5-7-16(23)8-6-15;/h5-10,13H,2-4,11-12H2,1H3,(H,27,30);1H
InChIKey REOYOKXLUFHOBV-UHFFFAOYSA-N
SMILES CC1=C(C2=CC=C(Cl)C=C2)N(C3=CC=C(Cl)C=C3Cl)N=C1C(NN4CCCCC4)=O.Cl
CAS DataBase Reference 158681-13-1(CAS DataBase Reference)

Safety Data

Hazard Codes  T,Xi
Risk Statements 
Safety Statements 
RIDADR  UN 2811 6.1 / PGIII
WGK Germany  3
Storage Class 6.1C - Combustible acute toxic Cat.3
toxic compounds or compounds which causing chronic effects
Hazard Classifications Acute Tox. 3 Oral
Eye Irrit. 2

Hazard Information

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