(S)-(+)-2-[Hydroxy(diphenyl)methyl]-1-methylpyrrolidine Structure

(S)-(+)-2-[Hydroxy(diphenyl)methyl]-1-methylpyrrolidine

Chemical Properties

Melting point 66-72 °C
alpha  +52° (c=1, CHCl3)
Boiling point 406.8±25.0 °C(Predicted)
Density  1.116±0.06 g/cm3(Predicted)
refractive index  55 ° (C=1, CHCl3)
storage temp.  Sealed in dry,2-8°C
solubility  sol hexane, benzene, toluene, Et2O, cyclohexane, dichloromethane
pka 13.15±0.29(Predicted)
form  Powder
color  white to pale-yellow
optical activity [α]20/D +55±3°, c = 1% in chloroform stab. with amylenes
BRN  4749387
InChI 1S/C18H21NO/c1-19-14-8-13-17(19)18(20,15-9-4-2-5-10-15)16-11-6-3-7-12-16/h2-7,9-12,17,20H,8,13-14H2,1H3/t17-/m0/s1
InChIKey XIJAGFLYYNXCAB-KRWDZBQOSA-N
SMILES CN1CCC[C@H]1C(O)(c2ccccc2)c3ccccc3
CAS DataBase Reference 110529-22-1(CAS DataBase Reference)
UNSPSC Code 12352005
NACRES NA.22
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Safety

Symbol(GHS) Exclamation Mark (GHS07)
Signal wordWarning
Hazard statements H315-H319-H335
Precautionary statements P261-P305+P351+P338
Hazard Codes  Xi
Risk Statements  36/37/38
Safety Statements  26-36
WGK Germany  3
F  10-34
HS Code  29339900
Storage Class 11 - Combustible Solids
Hazard Classifications Eye Irrit. 2
Skin Irrit. 2
STOT SE 3
NFPA 704:
1
2 0

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