Cas no 22029-76-1 (3-Buten-2-ol,4-(2,6,6-trimethyl-1-cyclohexen-1-yl)-)
3-Buten-2-ol,4-(2,6,6-trimethyl-1-cyclohexen-1-yl)- Chemical and Physical Properties
Names and Identifiers
-
- 3-Buten-2-ol,4-(2,6,6-trimethyl-1-cyclohexen-1-yl)-
- β-Ionol
- BETA-IONOL
- 4-(2,6,6-trimethyl-1-cyclohexen-1-yl)-3-buten-2-ol
- 4-(2,6,6-Trimethyl-1-cyclohexenyl)-3-buten-2-ol
- FEMA 3625
- EINECS 277-648-8
- AKOS027320412
- .BETA.-IONOL [FHFI]
- (+/-)-Trans-beta-I(Eonol
- Trans-beta-ionol
- UNII-HTL4B7G3HH
- FEMA No. 3625
- 73952-68-8
- beta-Ionol, (E)-
- b-Ionol
- 3-Buten-2-ol, 4-(2,6,6-trimethyl-1-cyclohexen-1-yl)-, (E)-
- EINECS 244-735-7
- (+/-)-TRANS-.BETA.-IONOL
- 472-80-0
- HTL4B7G3HH
- beta-Ionol, technical, >=90% (GC)
- (E)-4-(2,6,6-trimethylcyclohex-1-enyl)-3-buten-2-ol
- .BETA.-IONOL
- (3E)-4-(2,6,6-Trimethyl-1-cyclohexen-1-yl)-3-buten-2-ol #
- SCHEMBL891562
- CHEBI:191586
- 3-Buten-2-ol, 4-(2,6,6-trimethyl-1-cyclohexen-1-yl)-, (3E)-
- (E)-beta-ionol
- .beta. Ionol
- .BETA.-IONOL, (E)-
- TRANS-.BETA.-IONOL
- (E)-4-(2,6,6-trimethylcyclohexen-1-yl)but-3-en-2-ol
- (E)-4-(2,6,6-trimethylcyclohex-1-enyl)but-3-en-2-ol
- Q27280092
- 3-Buten-2-ol, 4-(2,6,6-trimethyl-1-cyclohexen-1-yl)-
- Ionol,beta
- 4-(2,6,6-trimethyl-cyclohex-1-enyl)-but-3-en-2-ol
- 2-Hydroxy-beta-ionone
- Ionol, beta-
- 4-(2,6,6-Trimethylcyclohex-1-en-1-yl)but-3-en-2-ol
- AI3-25084
- beta-Ionol, analytical standard
- CS-0336379
- 4-(2,6,6-Trimethyl-1-cyclohexenyl)-But-3-en-2-ol
- beta-lonol
- (3E)-4-(2,6,6-trimethylcyclohex-1-en-1-yl)but-3-en-2-ol
- But-3-en-2-ol, 4-(2,6,6-trimethyl-1-cyclohexenyl)-
- 22029-76-1
- STL560972
-
- MDL: MFCD00036597
- Inchi: 1S/C13H22O/c1-10-6-5-9-13(3,4)12(10)8-7-11(2)14/h7-8,11,14H,5-6,9H2,1-4H3/b8-7+
- InChI Key: CNOPDZWOYFOHGN-BQYQJAHWSA-N
- SMILES: OC(C)/C=C/C1=C(C)CCCC1(C)C
Computed Properties
- Exact Mass: 194.16700
- Monoisotopic Mass: 194.167
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 14
- Rotatable Bond Count: 2
- Complexity: 258
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 1
- Defined Bond Stereocenter Count: 1
- Undefined Bond Stereocenter Count: 0
- XLogP3: 2.9
- Topological Polar Surface Area: 20.2A^2
Experimental Properties
- Color/Form: Liquid, with strong raspberry and violet aromas, and fruity and woody notes
- Density: 0.928?g/mL?at 20?°C(lit.)
- Boiling Point: 107?°C/3?mmHg(lit.)
- Flash Point: Fahrenheit: 199.4 ° f < br / > Celsius: 93 ° C < br / >
- Refractive Index: n20/D 1.501
- PSA: 20.23000
- LogP: 3.45000
- Sensitiveness: Sensitive to air
- FEMA: 3625 | BETA-IONOL
3-Buten-2-ol,4-(2,6,6-trimethyl-1-cyclohexen-1-yl)- Security Information
- WGK Germany:2
- Safety Instruction: S23-S24/25
- FLUKA BRAND F CODES:10-23
- RTECS:EM9630000
3-Buten-2-ol,4-(2,6,6-trimethyl-1-cyclohexen-1-yl)- Pricemore >>
| Related Categories | No. | Product Name | Cas No. | Purity | Specification | Price | update time | Inquiry |
|---|---|---|---|---|---|---|---|---|
| SHANG HAI JI ZHI SHENG HUA Technology Co., Ltd. | I25900-5ml |
β-IONOL |
22029-76-1 | 90% | 5ml |
¥828.0 | 2023-09-07 | |
| SHANG HAI YI EN HUA XUE JI SHU Co., Ltd. | R026598-5ml |
3-Buten-2-ol,4-(2,6,6-trimethyl-1-cyclohexen-1-yl)- |
22029-76-1 | 90% | 5ml |
¥863 | 2023-07-18 | |
| Cooke Chemical | LN2463245-5ml |
β-Ionol |
22029-76-1 | 90% | 5ml |
RMB 690.40 | 2025-02-21 |
3-Buten-2-ol,4-(2,6,6-trimethyl-1-cyclohexen-1-yl)- Related Literature
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Tao Wang,Yangyang Liu,Yue Deng,Hongbo Fu,Jianmin Chen Environ. Sci.: Nano, 2018,5, 1821-1833
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Dhirendra K. Chaudhary,Pramendra Kumar,Lokendra Kumar RSC Adv., 2016,6, 94731-94738
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Jing Yu,Yu-Qi Lyu,Jiapeng Liu,Mohammed B. Effat,Junxiong Wu J. Mater. Chem. A, 2019,7, 17995-18002
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Min Kim,Jae-Joon Lee,Tengling Ye,Panagiotis E. Keivanidis,Kilwon Cho J. Mater. Chem. C, 2020,8, 1686-1696
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Olga Guselnikova,Gérard Audran,Jean-Patrick Joly,Andrii Trelin,Evgeny V. Tretyakov,Vaclav Svorcik,Oleksiy Lyutakov,Sylvain R. A. Marque Chem. Sci., 2021,12, 4154-4161
Additional information on 3-Buten-2-ol,4-(2,6,6-trimethyl-1-cyclohexen-1-yl)-
Comprehensive Overview of 3-Buten-2-ol,4-(2,6,6-trimethyl-1-cyclohexen-1-yl)- (CAS No. 22029-76-1): Properties, Applications, and Industry Trends
3-Buten-2-ol,4-(2,6,6-trimethyl-1-cyclohexen-1-yl)- (CAS No. 22029-76-1) is a specialized organic compound with a unique molecular structure that combines an unsaturated alcohol (3-Buten-2-ol) with a terpenoid-derived cyclohexene moiety. This compound has garnered significant attention in the fragrance and flavor industry due to its potential as a versatile intermediate. Its CAS registry number 22029-76-1 serves as a critical identifier for researchers and manufacturers seeking precise chemical data.
The structural features of this compound include a reactive butenol group and a trimethylcyclohexene ring, which contribute to its distinctive physicochemical properties. With a molecular formula of C13H22O, it exhibits moderate polarity and volatility, making it suitable for applications requiring controlled release or solubility in organic matrices. Recent studies highlight its role in synthesizing flavor enhancers and aromatic precursors, aligning with the growing demand for sustainable fragrance ingredients in cosmetics and food science.
In the context of green chemistry trends, 3-Buten-2-ol,4-(2,6,6-trimethyl-1-cyclohexen-1-yl)- has been explored as a bio-based alternative to synthetic aroma compounds. Researchers are investigating its derivatization potential to create low-impact fragrance molecules, addressing consumer preferences for eco-friendly products. Analytical techniques like GC-MS and NMR have been employed to characterize its purity and stability, ensuring compliance with international standards such as IFRA and FDA guidelines for ingredient safety.
The compound’s relevance extends to pheromone research, where its structural analogs are studied for insect behavior modulation—a topic gaining traction due to the global push for pesticide-free agriculture. Additionally, its CAS No. 22029-76-1 frequently appears in patent literature related to controlled-release formulations, reflecting innovation in encapsulation technologies for prolonged efficacy in functional products.
From a commercial perspective, suppliers of 3-Buten-2-ol derivatives emphasize scalability and cost-efficiency, particularly for niche markets like luxury perfumery and functional foods. Regulatory databases classify it as non-hazardous under normal handling conditions, though proper storage away from oxidizers is recommended. Its odor profile, often described as woody with citrus undertones, makes it valuable for creating complex scent accords in premium consumer goods.
Emerging applications include its use in biodegradable polymers as a crosslinking agent, capitalizing on its unsaturated bonds for polymerization reactions. This aligns with circular economy principles, a hot topic in material science forums. Furthermore, computational chemistry models predict its compatibility with other terpene-based compounds, opening avenues for novel hybrid materials in packaging and coatings.
For researchers querying "synthesis of 3-Buten-2-ol derivatives" or "CAS 22029-76-1 suppliers," this compound represents a bridge between academic exploration and industrial innovation. Its patent landscape reveals incremental improvements in catalytic conversion methods, reducing energy consumption—a key focus area for carbon-neutral manufacturing initiatives. Analytical certificates typically report ≥95% purity, with residual solvent levels adhering to ICH Q3C guidelines.
In summary, 3-Buten-2-ol,4-(2,6,6-trimethyl-1-cyclohexen-1-yl)- (CAS No. 22029-76-1) exemplifies the intersection of chemistry and sustainability. Its multifaceted applications—from fragrance design to advanced materials—underscore its value in addressing contemporary challenges while meeting stringent regulatory and environmental criteria.
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