2(3H)-Furanone, dihydro-4-(hydroxymethyl)-3-(6-methyl-1-oxoheptyl)-

Base Information

Chemical Name:2(3H)-Furanone, dihydro-4-(hydroxymethyl)-3-(6-methyl-1-oxoheptyl)-
CAS No.:88495-48-1
Molecular Formula:C13H22O4
Molecular Weight:
Hs Code.:
DSSTox Substance ID:DTXSID70435365
Nikkaji Number:J482.076B

Synonyms:2-isocapryloyl-3R-hydroxymethyl-gamma-butyrolactone;2S-isocapryloyl-3S-hydroxymethyl-gamma-butyrolactone;A-factor (Streptomyces);L-factor (Streptomyces)

Suppliers and Price of 2(3H)-Furanone, dihydro-4-(hydroxymethyl)-3-(6-methyl-1-oxoheptyl)-

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 7 raw suppliers

Chemical Property of 2(3H)-Furanone, dihydro-4-(hydroxymethyl)-3-(6-methyl-1-oxoheptyl)-

Chemical Property:

XLogP3:2.1
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:7
Exact Mass:242.15180918
Heavy Atom Count:17
Complexity:273

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

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CC(C)CCCCC(=O)C1C(COC1=O)CO

Technology Process of 2(3H)-Furanone, dihydro-4-(hydroxymethyl)-3-(6-methyl-1-oxoheptyl)-

There total 23 articles about 2(3H)-Furanone, dihydro-4-(hydroxymethyl)-3-(6-methyl-1-oxoheptyl)- 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: 72.0%

: 4-tert-butyl-dimethyl-silanyloxymethyl-3-(6-methyl-heptanoyl)-dihydro-furan-2-one

: 51311-41-2,60866-47-9,63122-21-4,75281-89-9,88495-48-1
3-hydroxymethyl-2-(6-methylheptanoyl)-4-butanolide

Guidance literature:: With formic acid; water; In tetrahydrofuran; at 20 ℃; for 18h; Inert atmosphere;
DOI:10.1039/c2ob06653j

Reference yield: 30.0%

: 80656-73-1
(R)-3-(6-Methyl-heptanoyl)-4-trimethylsilanyloxymethyl-dihydro-furan-2-one

: 51311-41-2,60866-47-9,63122-21-4,75281-89-9,88495-48-1
(3S)-(-)-2-(6-methylheptanoyl)-3-hydroxymethyl-4-butanolide

Guidance literature:: In ethanol; water; for 0.166667h; Heating;
DOI:10.1016/0040-4020(82)85019-9

Reference yield:

: 1653-40-3
6-methylheptanol

: 51311-41-2,60866-47-9,63122-21-4,75281-89-9,88495-48-1
3-hydroxymethyl-2-(6-methylheptanoyl)-4-butanolide

Guidance literature:: Multi-step reaction with 6 steps

1: 1.) (COCl)2, TEA / 1.) DMSO, DCM, -78 deg C; 2.) -78 deg C

2: 1.) HCl; 2.) PCC / 1.) r.t.; 2.) DCM

3: 1.) TEA, DMAP / 1.) DCM; 2.) toluene, 110 deg C

4: MnO₂, HCl

5: 1.) SOCl₂, DMF; 2.) H₂ / 2.) Pd-C / 1.) CHCl₃; 2.) MeOH

6: NaOMe / methanol / Ambient temperature

With hydrogenchloride; dmap; manganese(IV) oxide; thionyl chloride; oxalyl dichloride; TEA; hydrogen; sodium methylate; N,N-dimethyl-formamide; pyridinium chlorochromate; palladium on activated charcoal; In methanol;
DOI:10.1016/S0040-4039(00)73253-9