Ipomeamarone

Base Information

Chemical Name:Ipomeamarone
CAS No.:20007-82-3
Deprecated CAS:11033-12-8,26767-94-2
Molecular Formula:C15H22O3
Molecular Weight:250.338
Hs Code.:2932190090
NSC Number:317536,256944
DSSTox Substance ID:DTXSID90911590
Nikkaji Number:J113.260A
Wikidata:Q82881735
Mol file:20007-82-3.mol

Synonyms:ipomeamarone;ipomeamarone, (2R-cis)-isomer;ipomeamarone, (2S-cis)-isomer;ipomeamarone, (2S-trans)-isomer;ngaione

Suppliers and Price of Ipomeamarone

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

Total 9 raw suppliers

Chemical Property of Ipomeamarone

Chemical Property:

Boiling Point:343.6°Cat760mmHg
Flash Point:161.6°C
PSA：39.44000
Density:1.016g/cm³
LogP:3.89510
XLogP3:2.3
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:5
Exact Mass:250.15689456
Heavy Atom Count:18
Complexity:300

Purity/Quality:: 99% ^*data from raw suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CC(C)CC(=O)CC1(CCC(O1)C2=COC=C2)C

Technology Process of Ipomeamarone

There total 16 articles about Ipomeamarone 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: 37.0%

: 60007-02-5,131317-17-4,131317-25-4
bis-1,3-propane dithioketal of trans-4-methyl-1-(2,3,4,5-tetrahydro-5-methyl<2,3'-bifuran>-5-yl)-2-pentanone

: 494-23-5,581-12-4,19479-31-3,20007-82-3,27428-93-9,51703-93-6,51703-94-7,84620-58-6
trans-4-methyl-1-(2,3,4,5-tetrahydro-5-methyl<2,3'-bifuran>-5-yl)-2-pentanone

Guidance literature:: With N-chloro-succinimide; silver nitrate; In water; acetonitrile; at 0 ℃; for 0.0833333h;

Reference yield: 34.0%

: 60007-02-5,131317-17-4,131317-25-4
bis-1,3-propane dithioketal of cis-4-methyl-1-(2,3,4,5-tetrahydro-5-methyl<2,3'-bifuran>-5-yl)-2-pentanone

: 494-23-5,581-12-4,19479-31-3,20007-82-3,27428-93-9,51703-93-6,51703-94-7,84620-58-6
cis-4-methyl-1-(2,3,4,5-tetrahydro-5-methyl<2,3'-bifuran>-5-yl)-2-pentanone

Guidance literature:: With N-chloro-succinimide; silver nitrate; In water; acetonitrile; at 0 ℃; for 0.0833333h;

Reference yield:

: 131317-12-9,131317-23-2
5α-(3'-furyl)-2β-hydroxymethyl-2α-methyloxolane

: 494-23-5,581-12-4,19479-31-3,20007-82-3,27428-93-9,51703-93-6,51703-94-7,84620-58-6
trans-4-methyl-1-(2,3,4,5-tetrahydro-5-methyl<2,3'-bifuran>-5-yl)-2-pentanone

Guidance literature:: Multi-step reaction with 5 steps

1: 96 percent / pyridine / 12 h / 0 °C

2: 58 percent / NaI, HMPA, H₂O / 120 °C

3: 1.) n-BuLi / 1.) THF, hexane, -20 deg C, 2 h, 2a.) HMPA, diglyme, THF, -78 deg C, 2 h, 2b.) -20 deg C, 12 h

4: 1.) n-BuLi, 2.) HMPA / 1.) THF, hexane, -20 deg C, 7 h, 2.) -78 deg C, overnight

5: 37 percent / AgNO₃, N-chlorosuccinimide / acetonitrile; H₂O / 0.08 h / 0 °C

With pyridine; N,N,N,N,N,N-hexamethylphosphoric triamide; N-chloro-succinimide; n-butyllithium; water; silver nitrate; sodium iodide; In water; acetonitrile;