(R,S)-ANATABINE Structure

(R,S)-ANATABINE

Chemical Properties

Boiling point 136
Density  1.045±0.06 g/cm3(Predicted)
storage temp.  Amber Vial, Refrigerator, Under Inert Atmosphere
solubility  ≤15mg/ml in DMSO;15mg/ml in dimethyl formamide
form  solution in ethanol.
pka 8.84±0.40(Predicted)
color  Light yellow to yellow
Stability Hygroscopic, Light Sensitive
Major Application pharmaceutical (small molecule)
InChI InChI=1S/C10H12N2/c1-2-7-12-10(5-1)9-4-3-6-11-8-9/h1-4,6,8,10,12H,5,7H2
InChIKey SOPPBXUYQGUQHE-UHFFFAOYSA-N
SMILES C1(C2=CC=CN=C2)NCC=CC1
CAS DataBase Reference 2743-90-0
UNSPSC Code 41116107
NACRES NA.24

Safety

Symbol(GHS) Skull and Crossbones (GHS06)
Signal wordDanger
Hazard statements H301-H319
Precautionary statements P264-P270-P280-P301+P310-P305+P351+P338-P337+P313
Risk Statements  25-36
Safety Statements  24/25
RIDADR  2810
WGK Germany  WGK 3
HazardClass  IRRITANT
HS Code  29399990
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

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(R,S)-ANATABINE Chemical Properties,Usage,Production

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(R,S)-ANATABINE Spectrum