(6aR)-6-(2-chloroethyl)-5,6,6a,7-tetrahydro-4H-dibenzo[de,g]quinoline-10,11-diol;hydrochloride

Base Information

Chemical Name:(6aR)-6-(2-chloroethyl)-5,6,6a,7-tetrahydro-4H-dibenzo[de,g]quinoline-10,11-diol;hydrochloride
CAS No.:75344-87-5
Molecular Formula:C₁₈H₁₈ClNO₂*ClH
Molecular Weight:352.26
Hs Code.:
ChEMBL ID:CHEMBL3037936
DSSTox Substance ID:DTXSID00516732
Mol file:75344-87-5.mol

Synonyms:75344-87-5;(6aR)-6-(2-chloroethyl)-5,6,6a,7-tetrahydro-4H-dibenzo[de,g]quinoline-10,11-diol;hydrochloride;CHEMBL3037936;DTXSID00516732;R(-)-Chloroethylnorapomorphine hydrochloride, analytical standard;(6aR)-6-(2-Chloroethyl)-5,6,6a,7-tetrahydro-4H-dibenzo[de,g]quinoline-10,11-diol--hydrogen chloride (1/1)

Suppliers and Price of (6aR)-6-(2-chloroethyl)-5,6,6a,7-tetrahydro-4H-dibenzo[de,g]quinoline-10,11-diol;hydrochloride

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

Sigma-Aldrich
R(?)-Chloroethylnorapomorphine hydrochloride analytical standard
25mg
$ 193.00

Total 1 raw suppliers

Chemical Property of (6aR)-6-(2-chloroethyl)-5,6,6a,7-tetrahydro-4H-dibenzo[de,g]quinoline-10,11-diol;hydrochloride

Chemical Property:

PSA：43.70000
LogP:4.19880
Storage Temp.:2-8°C
Solubility.:0.1 M HCl: soluble
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:2
Exact Mass:351.0792842
Heavy Atom Count:23
Complexity:407

Purity/Quality:

98%Min ^*data from raw suppliers

R(?)-Chloroethylnorapomorphine hydrochloride analytical standard ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:C1CN(C2CC3=C(C4=CC=CC1=C24)C(=C(C=C3)O)O)CCCl.Cl
Isomeric SMILES:C1CN([C@@H]2CC3=C(C4=CC=CC1=C24)C(=C(C=C3)O)O)CCCl.Cl

Technology Process of (6aR)-6-(2-chloroethyl)-5,6,6a,7-tetrahydro-4H-dibenzo[de,g]quinoline-10,11-diol;hydrochloride

There total 2 articles about (6aR)-6-(2-chloroethyl)-5,6,6a,7-tetrahydro-4H-dibenzo[de,g]quinoline-10,11-diol;hydrochloride 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: 79.0%

: 75846-02-5
(-)-N-Hydroxyethylnorapomorphine hydrochloride

: 75344-87-5
(R)-(-)-N-(2-chloroethyl)norapomorphine hydrochloride

Guidance literature:: With thionyl chloride; In acetonitrile; for 12h; Ambient temperature;

Reference yield:

: 115017-62-4
(R)-6-(2-Hydroxy-ethyl)-10-methoxy-5,6,6a,7-tetrahydro-4H-dibenzo[de,g]quinolin-11-ol; hydrochloride

: 75344-87-5
(R)-(-)-N-(2-chloroethyl)norapomorphine hydrochloride

Guidance literature:: Multi-step reaction with 2 steps

1: 1.) HBr (48percent); 2.) HCl / 1.) 130 to 135 deg C, 4 h; 2.) ether

2: 79 percent / SOCl₂ / acetonitrile / 12 h / Ambient temperature

With hydrogenchloride; thionyl chloride; hydrogen bromide; In acetonitrile;