alpha-Ionol

Base Information

Chemical Name:alpha-Ionol
CAS No.:25312-34-9
Deprecated CAS:211241-68-8
Molecular Formula:C13H22O
Molecular Weight:194.317
Hs Code.:
European Community (EC) Number:246-815-7,207-455-6
UNII:4QI2W5Y52K
DSSTox Substance ID:DTXSID60885294
Nikkaji Number:J1.281.530A,J181.800G
Wikidata:Q27260370
Metabolomics Workbench ID:48323
ChEMBL ID:CHEMBL4445039
Mol file:25312-34-9.mol

Synonyms:alpha-Ionol;25312-34-9;alpha-lonol;latilure;(E)-4-(2,6,6-trimethylcyclohex-2-en-1-yl)but-3-en-2-ol;FEMA No. 3624;4,7-Megastigmadien-9-ol;.alpha.-Ionol;Ionol, alpha-;3-Buten-2-ol, 4-(2,6,6-trimethyl-2-cyclohexen-1-yl)-, (3E)-;4-(2,6,6-Trimethyl-2-cyclohexen-1-yl)-3-buten-2-ol;BRN 2327829;472-78-6;4-(2,6,6-Trimethyl-2-cyclohexenyl)-3-buten-2-ol;3-Buten-2-ol, 4-(2,6,6-trimethyl-2-cyclohexen-1-yl)-;EINECS 246-815-7;UNII-4QI2W5Y52K;AI3-36071;4QI2W5Y52K;EINECS 207-455-6;(E)-4-(2,6,6-trimethylcyclohex-2-enyl)but-3-en-2-ol;(3E)-4-(2,6,6-trimethylcyclohex-2-en-1-yl)but-3-en-2-ol;alpha -Ionol;IONOL, .ALPHA.-;.ALPHA.-IONOL [FHFI];SCHEMBL1245068;CHEMBL4445039;DTXSID60885294;CHEBI:191484;(+/-)-.ALPHA.-IONOL;.ALPHA.-IONOL, (+/-)-;LS-2833;alpha-Ionol, technical, >=90% (GC);W-107247;Q27260370;4-(2,6,6-trimethyl-1-cyclohex-2-enyl)but-3-en-2-ol;(E)-4-(2,6,6-Trimethyl-2-cyclohexenyl)-3-butene-2-ol;(3E)-4-(2,6,6-Trimethyl-2-cyclohexen-1-yl)-3-buten-2-ol;4-(2,6,6-Trimethyl-2-cyclohexen-1-yl)-3-buten-2-ol, 9CI;4-(2,6,6-Trimethyl-2-cyclohexen-1-yl)-trans-3-buten-2-ol;4-(2,6,6-Trimethyl-2-cyclohexenyl)-3-buten-2-ol, (3E)-;(3E)-4-(2,6,6-Trimethyl-2-cyclohexen-1-yl)-3-buten-2-ol #;(3E)-4-(2,6,6-TRIMETHYL-2-CYCLOHEXENYL)-3-BUTEN-2-OL;4 - (2,6,6 - trimethyl - 2 - cyclohexen - 1 - yl) - 3 - buten - 2 - ol

Suppliers and Price of alpha-Ionol

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
α-Ionol(TechnicalGrade)
2.5g
$ 665.00

Sigma-Aldrich
α-Ionol technical, ≥90% (GC)
5ml
$ 42.50

Total 20 raw suppliers

Chemical Property of alpha-Ionol

Chemical Property:

Vapor Pressure:0.0013mmHg at 25°C
Refractive Index:n20/D 1.491
Boiling Point:265 °C at 760 mmHg
PKA:14.40±0.20(Predicted)
Flash Point:96.2 °C
PSA：20.23000
Density:0.941 g/cm³
LogP:3.30590
Storage Temp.:Refrigerator, under inert atmosphere
Solubility.:Chloroform (Sparingly), Methanol (Slightly)
XLogP3:3
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:1
Rotatable Bond Count:2
Exact Mass:194.167065321
Heavy Atom Count:14
Complexity:248

Purity/Quality:

99.0.% ^*data from raw suppliers

α-Ionol(TechnicalGrade) ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:
Safety Statements: 23-24/25

MSDS Files:

SDS file from LookChem

Total 1 MSDS from other Authors

Useful:

Canonical SMILES:CC1=CCCC(C1C=CC(C)O)(C)C
Isomeric SMILES:CC1=CCCC(C1/C=C/C(C)O)(C)C
Description α-Ionol has the flavor of ionone, but softer and sweeter.
Uses α-Ionol is an intermediate in synthesizing Tabanone (T003450), found in oils of Trifolium pratense L. and is a potential natural antioxidant.

Technology Process of alpha-Ionol

There total 19 articles about alpha-Ionol 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: 98.0%

: 127-41-3,6901-97-9,14398-36-8,24190-29-2,30685-95-1,31798-12-6,52340-45-1,67529-94-6,67529-95-7
alpha-ionone

: 25312-34-9
alpha-ionol

Guidance literature:: With sodium tetrahydroborate; In ethanol; water;
DOI:10.1016/j.tetlet.2013.01.083

Reference yield: 93.0%

: 24190-29-2
(+)-(R)-α-Ionon

: 25312-34-9
alpha-ionol

Guidance literature:: With sodium tetrahydroborate; In methanol; 1.) 1 h, 0 deg C, 2) 3 h, room temperature;
DOI:10.1021/jo00290a057

Reference yield: 89.0%

: 24190-29-2
(R)-α-ionone

: 472-78-6,25312-34-9,99146-78-8,99146-79-9,120523-19-5,120574-00-7,124152-01-8
α-ionol

Guidance literature:: With 4 A molecular sieve; 1-Indanol; Zr(O-n-Pr)n-MCM-41; In n-heptane; at 75 ℃; for 9h; Further Variations:; Catalysts; Product distribution; Kinetics;
DOI:10.1002/1615-4169(200212)344:10<1120::AID-ADSC1120>3.0.CO;2-4