Fantofarone

Base Information

Chemical Name:Fantofarone
CAS No.:114432-13-2
Molecular Formula:C31H38 N2 O5 S
Molecular Weight:550.719
Hs Code.:
UNII:KU213XYO69
DSSTox Substance ID:DTXSID30150729
Nikkaji Number:J356.103H
Wikipedia:Fantofarone
Wikidata:Q5434391
NCI Thesaurus Code:C73029
Metabolomics Workbench ID:144620
ChEMBL ID:CHEMBL285855
Mol file:114432-13-2.mol

Synonyms:2-isopropyl-1-((4-(3-(N-methyl-N-(3,4-dimethoxy-beta-phenethyl)amino)propoxy)benzenesulfonyl))indolizine;fantofarone;SR 33557;SR-33557

Suppliers and Price of Fantofarone

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

DC Chemicals
Fantofarone >98%
100 mg
$ 650.00

DC Chemicals
Fantofarone >98%
1 g
$ 2200.00

DC Chemicals
Fantofarone >98%
250 mg
$ 1100.00

ChemScene
Fantofarone 98.56%
50mg
$ 500.00

ChemScene
Fantofarone 98.56%
25mg
$ 300.00

ChemScene
Fantofarone 98.56%
10mg
$ 150.00

ChemScene
Fantofarone 98.56%
5mg
$ 90.00

ChemScene
Fantofarone 98.56%
100mg
$ 650.00

Cayman Chemical
Fantofarone
25mg
$ 613.00

Cayman Chemical
Fantofarone
1mg
$ 35.00

Total 14 raw suppliers

Chemical Property of Fantofarone

Chemical Property:

Melting Point:82-83°
Boiling Point:°Cat760mmHg
PKA:8.34 ± 0.05(at 25℃)
Flash Point:°C
PSA：77.86000
Density:1.16g/cm³
LogP:6.93690
XLogP3:6.7
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:13
Exact Mass:550.25014349
Heavy Atom Count:39
Complexity:825

Purity/Quality:

99%, ^*data from raw suppliers

Fantofarone >98% ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CC(C)C1=CN2C=CC=CC2=C1S(=O)(=O)C3=CC=C(C=C3)OCCCN(C)CCC4=CC(=C(C=C4)OC)OC

Technology Process of Fantofarone

There total 11 articles about Fantofarone 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: 78.0%

: 3490-06-0
N-methylhomoveratrylamine

: 114432-17-6
2-Isopropyl-1-[4-(3-bromopropyloxy)benzenesulphonyl]indolizine

: 114432-13-2
fantofarone

Guidance literature:: With triethylamine; In toluene; for 24h; Heating;
DOI:10.1021/jm00084a002

Reference yield:

: 4377-33-7
2-chloromethylpyridine

: 114432-13-2
fantofarone

Guidance literature:: Multi-step reaction with 5 steps

1: AcONa / butan-1-ol

2: 70 percent / K₂CO₃ / butan-2-one / 2 h / Heating

3: 90 percent / aq. NaOH / ethanol / 24 h / Heating

4: 85 percent / K₂CO₃ / butan-2-one / 24 h / Heating

5: 78 percent / Et₃N / toluene / 24 h / Heating

With sodium hydroxide; sodium acetate; potassium carbonate; triethylamine; In ethanol; toluene; butanone; butan-1-ol;
DOI:10.1021/jm00084a002

Reference yield:

: 4377-33-7
2-chloromethylpyridine

: 114432-13-2
fantofarone

Guidance literature:: Multi-step reaction with 5 steps

1.1: sodium hydrogencarbonate; sodium sulfite / water / 2 h / 20 °C / Heating / reflux

1.2: 5.17 h / 20 - 100 °C

2.1: potassium carbonate / 24 h / Heating / reflux

3.1: sodium hydroxide; water / ethanol / 24 h / Heating / reflux

4.1: potassium carbonate / butanone / 24 h / Heating / reflux

5.1: triethylamine / toluene / 24 h / Heating / reflux

With sodium hydroxide; water; sodium hydrogencarbonate; potassium carbonate; triethylamine; sodium sulfite; In ethanol; water; toluene; butanone;