Effusol

Base Information

Chemical Name:Effusol
CAS No.:73166-28-6
Molecular Formula:C₁₇H₁₆O₂
Molecular Weight:252.313
Hs Code.:
NSC Number:371300
UNII:S436Y000RU
DSSTox Substance ID:DTXSID00223419
Nikkaji Number:J11.241K
Wikidata:Q83101860
Pharos Ligand ID:GA8B5LRAS372
Metabolomics Workbench ID:126528
ChEMBL ID:CHEMBL205119
Mol file:73166-28-6.mol

Synonyms:effusol

Suppliers and Price of Effusol

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

AvaChem
Effusol
20mg
$ 690.00

AvaChem
Effusol
5mg
$ 290.00

AvaChem
Effusol
1mg
$ 119.00

AvaChem
Effusol
10mg
$ 490.00

Arctom
Effusol ≥98%
10mg
$ 318.00

American Custom Chemicals Corporation
EFFUSOL 95.00%
5MG
$ 503.35

Total 19 raw suppliers

Chemical Property of Effusol

Chemical Property:

Vapor Pressure:5.59E-11mmHg at 25°C
Boiling Point:508.9°Cat760mmHg
Flash Point:248.4°C
PSA：40.46000
Density:1.229g/cm³
LogP:3.81480
XLogP3:4.3
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:1
Exact Mass:252.115029749
Heavy Atom Count:19
Complexity:340

Purity/Quality:

≥98% ^*data from raw suppliers

Effusol ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CC1=C(C=CC2=C1CCC3=C2C(=CC(=C3)O)C=C)O
Uses A metabolite of Dihydrophenanthrene. It showed a good antitumor activity.

Technology Process of Effusol

There total 12 articles about Effusol 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: 92.0%

: 35638-70-1
lithium methanethiolate

: 94742-84-4
5-ethenyl-2,7-dimethoxy-1-methyl-9,10-dihydrophenanthrene

: 73166-28-6
Effusol

: 94742-85-5
1-methyl-5-(2-methylthioethyl)-9,10-dihydrophenanthrene-2,7-diol

Guidance literature:: In N,N,N,N,N,N-hexamethylphosphoric triamide; at 160 ℃; for 2h;

Reference yield:

: 94742-84-4
5-ethenyl-2,7-dimethoxy-1-methyl-9,10-dihydrophenanthrene

: 73166-28-6
Effusol

: 94742-85-5
1-methyl-5-(2-methylthioethyl)-9,10-dihydrophenanthrene-2,7-diol

Guidance literature:: With lithium methanethiolate; In N,N,N,N,N,N-hexamethylphosphoric triamide; at 160 ℃; for 2h;

Reference yield:

: 2615-71-6
3-hydroxy-5-methyl-benzoic acid methyl ester

: 73166-28-6
Effusol

Guidance literature:: Multi-step reaction with 11 steps

1: 54 percent / Br₂ / CCl₄; CH₂Cl₂ / 0.08 h / Ambient temperature

2: 98 percent / K₂CO₃ / acetone / 1.5 h / Heating

3: 1.) Br₂, 2.) silver trifluoroacetate in benzene / 1.) CCl₄, a) irrad., reflux, 5.75 h, b) reflux, 1.5 h, 2.) CCl₄, benzene, 2.5 h

4: lithium methoxide / dimethylformamide / 14 h / 90 °C

5: 92 percent / conc. HCl, H₂ / 10 percent Pd/C / acetic acid

6: 98 percent / Br₂ / CH₂Cl₂

7: 68 percent / copper bronze / 2 h / 210 °C

8: 96 percent / LiAlH₄ / diethyl ether / 1 h / Heating

9: 88 percent / pyridinium chlorochromate / CH₂Cl₂ / 0.5 h / Ambient temperature

10: 96 percent / butyllithium / hexane; tetrahydrofuran / 0.5 h / Ambient temperature

11: 92 percent / hexamethylphosphoric acid triamide / 2 h / 160 °C

With hydrogenchloride; lithium aluminium tetrahydride; n-butyllithium; lithium methanolate; hydrogen; bromine; silver trifluoroacetate; copper; potassium carbonate; pyridinium chlorochromate; palladium on activated charcoal; In tetrahydrofuran; tetrachloromethane; N,N,N,N,N,N-hexamethylphosphoric triamide; diethyl ether; hexane; dichloromethane; acetic acid; N,N-dimethyl-formamide; acetone;