3-Hexyltetrahydro-4-hydroxy-6-undecyl-2H-pyran-2-one

Base Information

Chemical Name:3-Hexyltetrahydro-4-hydroxy-6-undecyl-2H-pyran-2-one
CAS No.:104801-94-7
Molecular Formula:C₂₂H₄₂O₃
Molecular Weight:354.574
Hs Code.:
European Community (EC) Number:600-601-3
DSSTox Substance ID:DTXSID501220690
Mol file:104801-94-7.mol

Synonyms:3-HEXYLTETRAHYDRO-4-HYDROXY-6-UNDECYL-2H-PYRAN-2-ONE;SCHEMBL7520205;LRXRIVSWHMVULO-UHFFFAOYSA-N;DTXSID501220690;AKOS015909753;FT-0669210;FT-0770526;rac-(2RS,3RS,5SR)-2-hexyl-3-hydroxy-5-undecyl-delta-valerolactone;(3S,4S,6R)-3-HEXYLTETRAHYDRO-4-HYDROXY-6-UNDECYL-2H-PYRAN-2-ONE;104801-94-7

Suppliers and Price of 3-Hexyltetrahydro-4-hydroxy-6-undecyl-2H-pyran-2-one

Supply Marketing:

Business phase:: The product has achieved commercial mass production^*data from LookChem market partment

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Chemical Property of 3-Hexyltetrahydro-4-hydroxy-6-undecyl-2H-pyran-2-one

Chemical Property:

XLogP3:8.3
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:15
Exact Mass:354.31339520
Heavy Atom Count:25
Complexity:329

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CCCCCCCCCCCC1CC(C(C(=O)O1)CCCCCC)O

Technology Process of 3-Hexyltetrahydro-4-hydroxy-6-undecyl-2H-pyran-2-one

There total 8 articles about 3-Hexyltetrahydro-4-hydroxy-6-undecyl-2H-pyran-2-one 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: 46.0%

: 104801-94-7
rac-(2RS,3RS,5SR)-2-hexyl-3-hydroxy-5-undecyl-δ-valerolactone

Guidance literature:

Reference yield:

: 124-07-2
Octanoic acid

: 68711-33-1,104801-94-7,104801-96-9,111466-64-9,130793-26-9,136890-12-5
(6R)-3-hexyl-3,4,5,6-tetrahydro-4-hydroxy-6-undecyl-2H-pyran-2-one

Guidance literature:: Multi-step reaction with 3 steps

1: 1.) diisopropylamine, BuLi / 1.) THF, hexane, a) -50 deg C, 15 min, b) RT, 1 h, 2.) -78 deg C, 3 h

2: H₂ / 10percent Pd/C / tetrahydrofuran / 760 Torr / Ambient temperature

3: p-TsOH, / CHCl₃ / Ambient temperature

With n-butyllithium; hydrogen; toluene-4-sulfonic acid; diisopropylamine; palladium on activated charcoal; In tetrahydrofuran; chloroform;
DOI:10.1021/jo00241a018

Reference yield:

: 112763-97-0
(R)-3-phenylmethyloxy-tetradecanal

: 68711-33-1,104801-94-7,104801-96-9,111466-64-9,130793-26-9,136890-12-5
(6R)-3-hexyl-3,4,5,6-tetrahydro-4-hydroxy-6-undecyl-2H-pyran-2-one

Guidance literature:: Multi-step reaction with 3 steps

1: 1.) diisopropylamine, BuLi / 1.) THF, hexane, a) -50 deg C, 15 min, b) RT, 1 h, 2.) -78 deg C, 3 h

2: H₂ / 10percent Pd/C / tetrahydrofuran / 760 Torr / Ambient temperature

3: p-TsOH, / CHCl₃ / Ambient temperature

With n-butyllithium; hydrogen; toluene-4-sulfonic acid; diisopropylamine; palladium on activated charcoal; In tetrahydrofuran; chloroform;
DOI:10.1021/jo00241a018