790676-40-3

Name (S)-(+)-N-3-Benzylnirvanol
CAS 790676-40-3
Molecular Formula C18H18N2O2
MDL Number MFCD09840024
Molecular Weight 294.352
MOL File 790676-40-3.mol
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Chemical Properties

Appearance Off-White Solid
Melting point  147-1500C
density  1.190±0.06 g/cm3(Predicted)
storage temp.  2-8°C
solubility  DMSO: >20mg/mL
form  powder
pka 8.02±0.70(Predicted)
color  Off-white to light yellow
InChI 1S/C18H18N2O2/c1-2-18(15-11-7-4-8-12-15)16(21)20(17(22)19-18)13-14-9-5-3-6-10-14/h3-12H,2,13H2,1H3,(H,19,22)/t18-/m0/s1
InChIKey ZMZDHUHMXXALFX-SFHVURJKSA-N
SMILES CC[C@]1(NC(=O)N(Cc2ccccc2)C1=O)c3ccccc3

Safety Data

Hazard Codes  Xn,N
Risk Statements 
Safety Statements 
RIDADR  UN 3077 9/PG 3
WGK Germany  3
Storage Class 11 - Combustible Solids
Hazard Classifications Acute Tox. 4 Oral
Aquatic Acute 1
Eye Irrit. 2

Hazard Information

Spectrum Detail

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