Troparil

Base Information Edit

Chemical Name:Troparil
CAS No.:50372-80-0
Molecular Formula:C16H21 N O2
Molecular Weight:259.348
Hs Code.:2933990090
UNII:AH3LC885W8
Nikkaji Number:J424.758B,J23.647K
Wikipedia:Troparil
Wikidata:Q7845610
Pharos Ligand ID:GR3M2L328DL6
ChEMBL ID:CHEMBL390742
Mol file:50372-80-0.mol

Synonyms:(1R-(exo,exo))-8-methyl-3-phenyl-8-azabicyclo(3.2.1)octane-2-carboxylic acid methyl ester;2-methoxycarbonyl-3-phenyltropane;troparil;troparil hydrochloride, (1R-(2-endo,3-exo))-isomer;troparil, (1R-(2-endo,3-exo))-isomer;troparil, (1S-(exo,exo))-isomer;troparil, (2-endo,3-exo)-isomer;troparil, 1,5-naphthalenedisulfonate (1:1), (1R-(exo,exo))-isomer;troparil, 1,5-naphthalenedisulfonate (1:1), (1S-(exo,exo))-isomer;troparil, 1,5-naphthalenedisulfonate (2:1), (1R-(exo,exo))-isomer;troparil, 1,5-naphthalenedisulfonate, (1R-(exo,exo))-isomer;troparil, 1R-(exo,exo)-isomer;Win 35,065;Win 35,065-2;Win 35,065-3;Win 35065;Win 35065-2;Win 35065-3;Win-35,065;Win-35065

Suppliers and Price of Troparil

Supply Marketing:Edit

Business phase:: The product has achieved commercial mass production^*data from LookChem market partment

Manufacturers and distributors:

Manufacture/Brand
Chemicals and raw materials
Packaging
price

TRC
[1R-(exo,exo)]-8-Methyl-3-phenyl-8-azabicyclo[3.2.1]octane-2-carboxylicAcidMethylEster
25 mg
$ 145.00

Sigma-Aldrich
D-CPT tartrate >94%, solid
5mg
$ 639.00

Medical Isotopes, Inc.
[1R-(exo,exo)]-8-Methyl-3-phenyl-8-azabicyclo[3.2.1]octane-2-carboxylicAcidMethylEster
250 mg
$ 2200.00

American Custom Chemicals Corporation
(-)-2BETA-CARBOMETHOXY-3BETA-PHENYLTROPANE TARTRATE 95.00%
5MG
$ 495.06

Total 31 raw suppliers

Chemical Property of Troparil Edit

Chemical Property:

Vapor Pressure:4.47E-05mmHg at 25°C
Boiling Point:350.2°C at 760 mmHg
PKA:9.95±0.60(Predicted)
Flash Point:121.3°C
PSA：144.60000
Density:1.099g/cm³
LogP:0.24120
Storage Temp.:−20°C
Solubility.:H2O: soluble
XLogP3:2.6
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:3
Exact Mass:259.157228913
Heavy Atom Count:19
Complexity:338

Purity/Quality:

99% ^*data from raw suppliers

[1R-(exo,exo)]-8-Methyl-3-phenyl-8-azabicyclo[3.2.1]octane-2-carboxylicAcidMethylEster ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:

SDS file from LookChem

Total 1 MSDS from other Authors

Useful:

Canonical SMILES:CN1C2CCC1C(C(C2)C3=CC=CC=C3)C(=O)OC
Isomeric SMILES:CN1[C@H]2CC[C@@H]1[C@H]([C@H](C2)C3=CC=CC=C3)C(=O)OC
Uses [1R-(exo,exo)]- 8-Methyl-3-phenyl-8-azabicyclo[3.2.1]octane-2-carboxylic Acid Methyl Ester is an intermediate in the synthesis of RTI-55 (R701010), a semi-synthetic alkaloid that is a cocaine analogue belonging to the phenyltropane group.

Technology Process of Troparil

There total 16 articles about Troparil which guide to synthetic route it. The literature collected by LookChem mainly comes from the sharing of users and the free literature resources found by Internet computing technology. We keep the original model of the professional version of literature to make it easier and faster for users to retrieve and use. At the same time, we analyze and calculate the most feasible synthesis route with the highest yield for your reference as below:

synthetic route:

Reference yield: 65.28%

: 100-58-3
phenylmagnesium bromide

: 50373-10-9
methyl ecgonidine

: 50370-54-2,50372-80-0,50583-05-6,57458-42-1,74163-83-0,74163-84-1,127379-25-3,127379-26-4
(1R,3S,5S)-8-Methyl-3-phenyl-8-aza-bicyclo[3.2.1]octane-2-carboxylic acid methyl ester

Guidance literature:: phenylmagnesium bromide; methyl ecgonidine; In diethyl ether; dichloromethane; at -78 - -40 ℃; for 3.5h; Inert atmosphere;

With trifluoroacetic acid; In diethyl ether; dichloromethane; Inert atmosphere;
DOI:10.1016/j.bmc.2013.10.046