Eptastigmine

Base Information

Chemical Name:Eptastigmine
CAS No.:101246-68-8
Molecular Formula:C₂₁H₃₃N₃O₂
Molecular Weight:359.512
Hs Code.:
UNII:6PZZ52D76Q
DSSTox Substance ID:DTXSID801317905
Nikkaji Number:J134.046H
Wikidata:Q27265299
NCI Thesaurus Code:C65525
Pharos Ligand ID:HGQ1R7A95GRR
ChEMBL ID:CHEMBL433041
Mol file:101246-68-8.mol

Synonyms:eptastigmine;heptastigmine;heptyl physostigmine;heptyl-physostigmine;heptylphysostigmine;MF 201;MF-201;physostigmine heptyl;pyrrolo(2,3-b)indol-5-ol-1,2,3,3a,8,8a-hexahydro-1,3a,8-trimethyl heptylcarbamate ester

Suppliers and Price of Eptastigmine

Supply Marketing:

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

American Custom Chemicals Corporation
EPTASTIGMINE 95.00%
5MG
$ 495.72

Total 7 raw suppliers

Chemical Property of Eptastigmine

Chemical Property:

Vapor Pressure:4.91E-09mmHg at 25°C
Melting Point:60-64°
Refractive Index:1.6300 (estimate)
Boiling Point:470.8°Cat760mmHg
PKA:12.29±0.46(Predicted)
Flash Point:238.5°C
PSA：44.81000
Density:1.072g/cm³
LogP:4.50830
XLogP3:3.6
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:8
Exact Mass:359.25727730
Heavy Atom Count:26
Complexity:486

Purity/Quality:

99% ^*data from raw suppliers

EPTASTIGMINE 95.00% ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CCCCCCCNC(=O)OC1=CC2=C(C=C1)N(C3C2(CCN3C)C)C
Isomeric SMILES:CCCCCCCNC(=O)OC1=CC2=C(C=C1)N([C@@H]3[C@]2(CCN3C)C)C

Technology Process of Eptastigmine

There total 1 articles about Eptastigmine 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:

: 4747-81-3
N-heptylisocyanate

: 57-47-6
Physostigmin

: 101246-68-8
eptastigmine

Guidance literature:: Physostigmin; With sodium methylate; In ethanol; at 20 ℃;

N-heptylisocyanate; In benzene; for 3h;
DOI:10.1002/jbt.10026