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HomeProduct name listN-Benzyltropinone

N-Benzyltropinone

  • CAS NO.:28957-72-4
  • Empirical Formula: C14H17NO
  • Molecular Weight: 215.29
  • MDL number: MFCD00151640
  • EINECS: 249-329-3
  • SAFETY DATA SHEET (SDS)
  • Update Date: 2023-11-01 18:37:15
N-Benzyltropinone Structural

What is N-Benzyltropinone?

Chemical properties

Off-White to Pale Yellow Low-Melting Solid

The Uses of N-Benzyltropinone

An intermediate for the preparation of β-Cocaine, opioid receptor antagonists, and CCR-5 receptor antagonists

Properties of N-Benzyltropinone

Melting point: 28-29°C
Boiling point: 134-137°C/0.4 mm
Density  1.140±0.06 g/cm3(Predicted)
refractive index  1.556
storage temp.  Sealed in dry,Room Temperature
solubility  Chloroform, Dichloromethane, Methanol
form  Solid
pka 7.98±0.20(Predicted)
color  Off-White to Pale Yellow Low-Melting
InChI InChI=1S/C14H17NO/c16-14-8-12-6-7-13(9-14)15(12)10-11-4-2-1-3-5-11/h1-5,12-13H,6-10H2
CAS DataBase Reference 28957-72-4(CAS DataBase Reference)

Safety information for N-Benzyltropinone

Signal word Warning
Pictogram(s)
ghs
Exclamation Mark
Irritant
GHS07
GHS Hazard Statements H315:Skin corrosion/irritation
H319:Serious eye damage/eye irritation
H335:Specific target organ toxicity, single exposure;Respiratory tract irritation
Precautionary Statement Codes P261:Avoid breathing dust/fume/gas/mist/vapours/spray.
P305+P351+P338:IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continuerinsing.

Computed Descriptors for N-Benzyltropinone

InChIKey RSUHKGOVXMXCND-UHFFFAOYSA-N
SMILES C12N(CC3=CC=CC=C3)C(CC1)CC(=O)C2

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