Methylecgonidine

Base Information Edit

Chemical Name:Methylecgonidine
CAS No.:43021-26-7
Molecular Formula:C10H15NO2
Molecular Weight:181.235
Hs Code.:2933990090
European Community (EC) Number:636-970-2
UNII:58C337KP3E
DSSTox Substance ID:DTXSID20276220
Nikkaji Number:J356.372C
Wikipedia:Methylecgonidine
Wikidata:Q10858037
ChEMBL ID:CHEMBL451136
Mol file:43021-26-7.mol

Synonyms:anhydroecgonine methyl ester;anhydromethylecgonine;methylecgonidine

Suppliers and Price of Methylecgonidine

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

Sigma-Aldrich
Anhydroecgonine methyl ester solution 1.0?mg/mL in acetonitrile, ampule of 1?mL, certified reference material, Cerilliant?
1 mL
$ 89.00

Sigma-Aldrich
Anhydroecgonine methyl ester solution 1.0mg/mL in acetonitrile, ampule of 1mL, certified reference material
034-1ml
$ 89.00

AHH
Ecgonidinemethylestermesylate 98%
0.1g
$ 375.00

Total 9 raw suppliers

Chemical Property of Methylecgonidine Edit

Chemical Property:

Vapor Pressure:0.0219mmHg at 25°C
Boiling Point:250.2°C at 760 mmHg
PKA:7.97±0.40(Predicted)
Flash Point:96.9°C
PSA：29.54000
Density:1.112g/cm³
LogP:0.89020
Storage Temp.:−20°C
Solubility.:Chloroform (Slightly), Methanol (Slightly)
XLogP3:1.1
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:2
Exact Mass:181.110278721
Heavy Atom Count:13
Complexity:260

Purity/Quality:

98%min ^*data from raw suppliers

Anhydroecgonine methyl ester solution 1.0?mg/mL in acetonitrile, ampule of 1?mL, certified reference material, Cerilliant? ^*data from reagent suppliers

Safty Information:

Pictogram(s): T+
Hazard Codes:T+,Xn,F
Statements: 26/27/28-43-36-20/21/22-11
Safety Statements: 22-36/37/39-45-36/37-26-16

MSDS Files:

SDS file from LookChem

Total 1 MSDS from other Authors

Useful:

Chemical Classes:Other Uses -> Biochemical Research
Canonical SMILES:CN1C2CCC1C(=CC2)C(=O)OC
Isomeric SMILES:CN1[C@H]2CC[C@@H]1C(=CC2)C(=O)OC
Uses A metabolite of Cocaine (COC). It is a pyrolysis product formed when crack cocaine is smoked, making this substance a useful biomarker to specifically test for use of crack cocaine, as opposed to powder cocaine which does not form methylecgonidine as a metabolite.Controlled substance in some countries. Ecgonidine methyl ester mesylate is a metabolite of Cocaine (COC). It is a pyrolysis product formed when crack cocaine is smoked, making this substance a useful biomarker to specifically test for use of crack cocaine, as opposed to powder cocaine which does not form methylecgonidine as a metabolite. Controlled substance in some countries.

Technology Process of Methylecgonidine

There total 13 articles about Methylecgonidine 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: 93.0%