beta-Ionol

Base Information

Chemical Name:beta-Ionol
CAS No.:472-80-0
Molecular Formula:C₁₃H₂₂O
Molecular Weight:194.317
Hs Code.:
European Community (EC) Number:244-735-7
UNII:HTL4B7G3HH
Nikkaji Number:J1.112.924B,J146.841C,J2.211.646K
Wikidata:Q27280092
Metabolomics Workbench ID:47520
Mol file:472-80-0.mol

Synonyms:beta-Ionol;22029-76-1;Ionol, beta-;4-(2,6,6-Trimethyl-1-cyclohexen-1-yl)-3-buten-2-ol;2-Hydroxy-beta-ionone;FEMA No. 3625;472-80-0;beta-lonol;Ionol,beta;3-Buten-2-ol, 4-(2,6,6-trimethyl-1-cyclohexen-1-yl)-;Trans-beta-ionol;4-(2,6,6-Trimethylcyclohex-1-en-1-yl)but-3-en-2-ol;4-(2,6,6-Trimethyl-1-cyclohexenyl)-3-buten-2-ol;beta-Ionol, (E)-;(E)-4-(2,6,6-trimethylcyclohexen-1-yl)but-3-en-2-ol;UNII-HTL4B7G3HH;HTL4B7G3HH;(+/-)-Trans-beta-I(Eonol;EINECS 244-735-7;(E)-4-(2,6,6-trimethylcyclohex-1-enyl)-3-buten-2-ol;(3E)-4-(2,6,6-trimethylcyclohex-1-en-1-yl)but-3-en-2-ol;AI3-25084;3-Buten-2-ol, 4-(2,6,6-trimethyl-1-cyclohexen-1-yl)-, (3E)-;3-Buten-2-ol, 4-(2,6,6-trimethyl-1-cyclohexen-1-yl)-, (E)-;b-Ionol;.beta. Ionol;(E)-beta-ionol;-IONOL;.BETA.-IONOL;TRANS-.BETA.-IONOL;SCHEMBL891562;.BETA.-IONOL [FHFI];beta-Ionol, analytical standard;.BETA.-IONOL, (E)-;CHEBI:191586;EINECS 277-648-8;STL560972;(+/-)-TRANS-.BETA.-IONOL;AKOS027320412;beta-Ionol, technical, >=90% (GC);LS-2834;CS-0336379;4-(2,6,6-trimethyl-1-cyclohexenyl)but-3-en-2-ol;4-(2,6,6-Trimethyl-1-cyclohexenyl)-But-3-en-2-ol;Q27280092;4-(2,6,6-trimethyl-cyclohex-1-enyl)-but-3-en-2-ol;But-3-en-2-ol, 4-(2,6,6-trimethyl-1-cyclohexenyl)-;(E)-4-(2,6,6-Trimethyl-1-cyclohexenyl)-3-butene-2-ol;(E)-4-(2,6,6-trimethylcyclohex-1-enyl)but-3-en-2-ol;3-Buten-2-ol,4-(2,6,6-trimethyl-1-cyclohexen-1-yl)-;(3Z)-4-(1,3,3-Trimethylcyclohexene-2-yl)-3-butene-2-ol;(3E)-4-(2,6,6-Trimethyl-1-cyclohexen-1-yl)-3-buten-2-ol #

Suppliers and Price of beta-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

Total 0 raw suppliers

Chemical Property of beta-Ionol

Chemical Property:

Boiling Point:107 °C(Press: 3 Torr)
PSA：20.23000
Density:0.950±0.06 g/cm3(Predicted)
LogP:3.45000
XLogP3:2.9
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:1
Rotatable Bond Count:2
Exact Mass:194.167065321
Heavy Atom Count:14
Complexity:258

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CC1=C(C(CCC1)(C)C)C=CC(C)O
Isomeric SMILES:CC1=C(C(CCC1)(C)C)/C=C/C(C)O

Technology Process of beta-Ionol

There total 25 articles about beta-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: 100.0%

: 79-77-6,14901-07-6
(E)-β-ionone

: 22029-76-1,27008-60-2,35031-11-9,53078-25-4,53108-96-6,81600-95-5,81801-17-4,83348-85-0,472-80-0
beta-ionol

Guidance literature:: With Zn(BH₄)2(Ph₃P)2; In tetrahydrofuran; for 1.3h; Heating;
DOI:10.1080/10426509808029675

Reference yield: 97.0%

: 79-77-6,14901-07-6
4-(2,6,6-trimethyl-1-cyclohexen-1-yl)-3-buten-2-one

: 472-80-0,35031-11-9,53078-25-4,53108-96-6,81600-95-5,81801-17-4,83348-85-0,22029-76-1,27008-60-2
beta-Ionol

Guidance literature:: With Zn⁽²⁺⁾*2BH₄^(1-)*C₆H₇NO; In acetonitrile; at 20 ℃; for 0.25h; Reagent/catalyst; chemoselective reaction;
DOI:10.13005/ojc/290233

Reference yield: 93.0%

: 79-77-6,14901-07-6
4-(2,6,6-trimethyl-1-cyclohexen-1-yl)-3-buten-2-one

: 22029-76-1,27008-60-2,35031-11-9,53078-25-4,53108-96-6,81600-95-5,81801-17-4,83348-85-0,472-80-0
beta-ionol

Guidance literature:: With sodium tetrahydroborate; calcium(II) trifluoromethanesulfonate; In tetrahydrofuran; methanol; at 20 ℃; for 0.5h; regioselective reaction; Inert atmosphere;
DOI:10.1039/c2gc35619h