(3R)-hydroxy-beta-ionone

Base Information

Chemical Name:(3R)-hydroxy-beta-ionone
CAS No.:50281-38-4
Molecular Formula:C13H20O2
Molecular Weight:208.301
Hs Code.:
DSSTox Substance ID:DTXSID80456187
Nikkaji Number:J1.230.498F,J1.643.347K
Wikidata:Q27123998
Metabolomics Workbench ID:58581
Mol file:50281-38-4.mol

Synonyms:(3R)-hydroxy-beta-ionone;Apo-9-zeaxanthinone;50281-38-4;(E)-4-[(4R)-4-hydroxy-2,6,6-trimethylcyclohexen-1-yl]but-3-en-2-one;(3R)-3-Hydroxy-beta-ionone;(3E)-4-[(4R)-4-hydroxy-2,6,6-trimethylcyclohex-1-en-1-yl]but-3-en-2-one;(R,E)-4-(4-Hydroxy-2,6,6-trimethylcyclohex-1-en-1-yl)but-3-en-2-one;3-Hydroxy-b-ionone;(?)-3-Hydroxy-beta-ionone;SCHEMBL10451761;CHEBI:53173;DTXSID80456187;Q27123998;1-(4beta-Hydroxy-2,6,6-trimethyl-1-cyclohexenyl)-1-butene-3-one

Suppliers and Price of (3R)-hydroxy-beta-ionone

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

TRC
(3R)-3-Hydroxy-β-ionone
5mg
$ 195.00

Total 5 raw suppliers

Chemical Property of (3R)-hydroxy-beta-ionone

Chemical Property:

Boiling Point:333.0±25.0 °C(Predicted)
PKA:14.82±0.70(Predicted)
PSA：37.30000
Density:1.038±0.06 g/cm3(Predicted)
LogP:2.62900
XLogP3:1.6
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:2
Exact Mass:208.146329876
Heavy Atom Count:15
Complexity:321

Purity/Quality:

97% ^*data from raw suppliers

(3R)-3-Hydroxy-β-ionone ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CC1=C(C(CC(C1)O)(C)C)C=CC(=O)C
Isomeric SMILES:CC1=C(C(C[C@@H](C1)O)(C)C)/C=C/C(=O)C
Uses A naturally occurring apocaratenoid that is produced from (3R)-β-Cryptoxanthin (C827500) by oxidative cleavage catalyzed by the caratenoid cleavage oxygenase RdCCD1.

Technology Process of (3R)-hydroxy-beta-ionone

There total 27 articles about (3R)-hydroxy-beta-ionone 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: 100.0%

: 83021-07-2
(S,E)-4-[4-(tert-butyldimethylsilyloxy)-2,6,6-trimethylcyclohex-1-en-1-yl]but-3-en-2-one

: 50281-38-4
(3R)-3-hydroxy-β-ionone

Guidance literature:: With hydrogen fluoride;
DOI:10.3987/com-99-s54

Reference yield: 100.0%

: (R)-3,5,5-trimethyl-4-[(E)-3-oxobut-1-enyl]cyclohex-3-enyl 3,5-dinitrobenzoate

: 50281-38-4
(3R)-3-hydroxy-β-ionone

Guidance literature:: With methanol; diethylamine; In tetrahydrofuran; at 20 ℃; for 1h; Reagent/catalyst; Solvent; Catalytic behavior; Kinetics; Inert atmosphere;
DOI:10.1248/cpb.c17-00462

Reference yield: 99.0%

: 54165-55-8
(3R)-3-Acetoxy-β-ionon

: 50281-38-4
(3R)-3-hydroxy-β-ionone

Guidance literature:: With potassium hydroxide; In methanol; dichloromethane; at 0 ℃; for 2h; optical yield given as %ee;
DOI:10.1055/s-0030-1258382