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: 2026-06-04 16:00:12
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) |
 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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