(1S,9S)-11-methyl-7,11-diazatricyclo[7.3.1.0<2,7>]trideca-2,4-dien-6-one

Base Information

Chemical Name:(1S,9S)-11-methyl-7,11-diazatricyclo[7.3.1.0<2,7>]trideca-2,4-dien-6-one
CAS No.:486-86-2
Molecular Formula:C12H16 N2 O
Molecular Weight:204.272
Hs Code.:
European Community (EC) Number:207-643-8
DSSTox Substance ID:DTXSID80876866
Mol file:486-86-2.mol

Synonyms:Caulophylline;Oprea1_623608;DTXSID80876866;486-86-2;AKOS024277848;(1S,9S)-11-methyl-7,11-diazatricyclo[7.3.1.0<2,7>]trideca-2,4-dien-6-one

Suppliers and Price of (1S,9S)-11-methyl-7,11-diazatricyclo[7.3.1.0<2,7>]trideca-2,4-dien-6-one

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

Usbiological
N-Methylcytisine
25mg
$ 460.00

Usbiological
N-Methylcytisine
10mg
$ 468.00

TRC
N-Methylcytisine
100mg
$ 460.00

TRC
N-Methylcytisine
25mg
$ 135.00

Sigma-Aldrich
N-Methylcytisine ≥98% (HPLC)
5mg
$ 158.00

Sigma-Aldrich
N-Methylcytisine AldrichCPR
25mg
$ 258.00

Sigma-Aldrich
N-Methylcytisine phyproof? Reference Substance
10 mg
$ 289.00

Medical Isotopes, Inc.
N-Methylcytisine
125 mg
$ 1600.00

Medical Isotopes, Inc.
N-Methylcytisine
25 mg
$ 825.00

DC Chemicals
Caulophylline >98%,StandardReferencesGrade
20 mg
$ 280.00

Total 61 raw suppliers

Chemical Property of (1S,9S)-11-methyl-7,11-diazatricyclo[7.3.1.0<2,7>]trideca-2,4-dien-6-one

Chemical Property:

Vapor Pressure:1.24E-06mmHg at 25°C
Melting Point:137-139oC
Refractive Index:1.616
Boiling Point:400.8°Cat760mmHg
PKA:9.61±0.20(Predicted)
Flash Point:191.9°C
PSA：25.24000
Density:1.21g/cm³
LogP:0.83510
Storage Temp.:-20?C Freezer, Under Inert Atmosphere
Solubility.:Chloroform (Slightly), Ethyl Acetate (Slightly), Methanol (Slightly)
XLogP3:0.7
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:0
Exact Mass:204.126263138
Heavy Atom Count:15
Complexity:359

Purity/Quality:

≥98% ^*data from raw suppliers

N-Methylcytisine ^*data from reagent suppliers

Safty Information:

Pictogram(s): Xn
Hazard Codes:Xn
Statements: 22

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CN1CC2CC(C1)C3=CC=CC(=O)N3C2
Isomeric SMILES:CN1C[C@@H]2CC(C1)C3=CC=CC(=O)N3C2
Description This base was first prepared synthetically by Partheil and subsequently discovered in the roots of Caulophyllurn thalictroides L. It is widespread among the Papilionaceae, being found in Baptisia australis, Genista tinctoria, Sophora microphylla, S. tetraptera, Thermopsis lanceolata and T. rhombifolia (Watt.) Richards. It is laevorotatory with [α]20D - 221 ° (H20) and furnishes the following crystalline salts and derivatives: hydrochloride, m.p. 2S0-SoC (dec.); hydriodide, m.p. 246-7°C (dec.); perchlorate, m.p. 2S4°C (dec.); aurichloride, m.p. 206°C (dec.); picrate, m.p. 230°C; picrolonate, m.p. 224-SoC (dec.) and the methiodide which occurs in two modifications, m.p. 248°C and 267-276°C.
Uses N-Methylcytisine (cas# 486-86-2) is a compound useful in organic synthesis.

Technology Process of (1S,9S)-11-methyl-7,11-diazatricyclo[7.3.1.0<2,7>]trideca-2,4-dien-6-one

There total 8 articles about (1S,9S)-11-methyl-7,11-diazatricyclo[7.3.1.0<2,7>]trideca-2,4-dien-6-one 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: 99.0%

: 50-00-0,30525-89-4,61233-19-0
formaldehyd

: 485-35-8
cytisine

: 486-86-2
(-)-N-methylcystine

Guidance literature:: With sodium cyanoborohydride; In tetrahydrofuran; methanol; water; at 20 ℃; for 1.5h; Inert atmosphere;
DOI:10.1055/s-0029-1219377