beta-Ionone

Base Information Edit

Chemical Name:beta-Ionone
CAS No.:79-77-6
Deprecated CAS:1353674-22-2
Molecular Formula:C13H20O
Molecular Weight:192.301
Hs Code.:2914 23 00
European Community (EC) Number:201-224-3,238-969-9
NSC Number:402758,46137
UNII:A7NRR1HLH6
DSSTox Substance ID:DTXSID4021769
Nikkaji Number:J4.392C,J70.102E
Wikidata:Q27114873
RXCUI:2371702
Metabolomics Workbench ID:47389
ChEMBL ID:CHEMBL559945
Mol file:79-77-6.mol

Synonyms:4-(2,6,6-trimethyl-1-cyclohexen-1-yl)-3-buten-2-one;beta-ionone;beta-ionone, (trans)-isomer

Suppliers and Price of beta-Ionone

Supply Marketing:Edit

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
β-Ionone
25g
$ 185.00

TRC
β-Ionone
1g
$ 145.00

Sigma-Aldrich
?-Ionone forsynthesis
100 mL
$ 71.87

Sigma-Aldrich
-Ionone -Ionone for synthesis. CAS 79-77-6, molar mass 192.3 g/mol., for synthesis
8186190100
$ 62.20

Medical Isotopes, Inc.
β-Ionone
25 g
$ 650.00

Crysdot
(E)-4-(2,6,6-Trimethylcyclohex-1-en-1-yl)but-3-en-2-one 95+%
100g
$ 50.00

Chem-Impex
β-Ionone,≥98%(GC),FG,KOSHER,FEMA2595Hazmat ≥98%(GC)
100G
$ 20.80

Chem-Impex
β-Ionone,≥98%(GC),FG,KOSHER,FEMA2595Hazmat ≥98%(GC)
5KG
$ 260.00

Ambeed
β-Ionone 95%
500g
$ 86.00

Ambeed
β-Ionone 95%
100g
$ 23.00

Total 101 raw suppliers

Chemical Property of beta-Ionone Edit

Chemical Property:

Vapor Pressure:<1 hPa (25 °C)
Melting Point:-49 °C
Refractive Index:n20/D 1.52(lit.)
Boiling Point:254.816 °C at 760 mmHg
Flash Point:121.291 °C
PSA：17.07000
Density:0.944 g/cm³
LogP:3.65820
Storage Temp.:2-8°C
Solubility.:0.11g/l insoluble
Water Solubility.:Soluble in water (0.11 mg/mI at 20°C).
XLogP3:2.9
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:1
Rotatable Bond Count:2
Exact Mass:192.151415257
Heavy Atom Count:14
Complexity:292

Purity/Quality:

99% ^*data from raw suppliers

β-Ionone ^*data from reagent suppliers

Safty Information:

Pictogram(s): Xi,N
Hazard Codes:Xi,N
Statements: 38-51/53-36
Safety Statements: 61-36/37-26

MSDS Files:

SDS file from LookChem

Total 1 MSDS from other Authors

Useful:

Canonical SMILES:CC1=C(C(CCC1)(C)C)C=CC(=O)C
Isomeric SMILES:CC1=C(C(CCC1)(C)C)/C=C/C(=O)C
Uses An aroma compound commonly found in essential oils such as rose oil. β-Lonone is an important fragrance chemical used in perfumery. β-Ionone is effective in the chemoprevention of rat mammary carcinogenesis. It is an important fragrance chemical used in perfumery. The combination of α-ionone and β-ionone is characteristic of the scent of violets and used with other components in flavoring to recreate their scent.

Technology Process of beta-Ionone

There total 144 articles about 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: 98.0%