4-Cyclohexyl-2-methyl-2-butanol (CAS 83926-73-2) — Woody Middle Note Fragrance Ingredient
4-Cyclohexyl-2-methyl-2-butanol
CAS 83926-73-2
What Is 4-Cyclohexyl-2-methyl-2-butanol?
4-Cyclohexyl-2-methyl-2-butanol is a synthetic fragrance ingredient used in perfumes and personal care products. It contributes woody, musky notes to formulations. This molecule is valued for its ability to enhance longevity and add depth to fragrance compositions without being overpowering.
Safety Profile
GENERALLY SAFEWhat Does 4-Cyclohexyl-2-methyl-2-butanol Smell Like?
4-Cyclohexyl-2-methyl-2-butanol presents a clean, woody-musky character with subtle amber undertones. The scent evolves from a fresh, slightly herbal opening to a warm, persistent dry-down reminiscent of polished wood and clean skin. Its moderate volatility makes it useful as a bridge between top and middle notes, adding subtle sophistication without dominating a composition.
In Famous Fragrances
Fragrance associations may not reflect actual formulations.
Used as a woody-musky backbone that harmonizes citrus top notes with amber base notes, providing seamless transitions.
Adds subtle sophistication to this modern woody fragrance, enhancing longevity without heaviness.
2D Molecular Structure
SMILES: CC(C)(O)CCC1CCCCC1
Chemistry, Properties & Perfumer Guide
The Chemistry
4-Cyclohexyl-2-methyl-2-butanol is a tertiary alcohol with a cyclohexyl substituent. Its synthesis typically involves Grignard reactions or hydroformylation of suitable precursors. The molecule’s structure provides good stability and moderate volatility, making it useful in fragrance applications. The cyclohexyl group contributes to its woody character while the tertiary alcohol moiety enhances solubility in common fragrance bases.
Physical & Chemical Properties
| Boiling Point | Not available |
|---|---|
| Density | Not available |
Perfumer Guide
| Application | Typical % | Range | Notes |
|---|---|---|---|
| Fine Fragrance | 1-3% | Up to 5% | Woody-musky modifier |
| Personal Care | 0.5-1.5% | Up to 2% | Subtle woody note |
Classic Accords
Tip: Use to add woody sophistication without overwhelming other notes.
Alternatives & Comparisons
Safety, Regulatory & Sustainability
⚠ Regulatory Disclaimer
General reference only. Consult current IFRA Standards Library before formulating.
IFRA Status
No IFRA restrictions currently apply.
RIFM Assessment
Limited safety assessment available; considered safe at current usage levels.
Sustainability
As a synthetic material, production can be optimized for minimal environmental impact. No natural resources are required, and manufacturing can be controlled for efficiency. Future developments may focus on greener synthesis routes.
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References
- Bauer et al. (2001). Common Fragrance and Flavor Materials. Wiley-VCH.
- Arctander, S. (1969). Perfume and Flavor Chemicals. Allured.
Data: PubChem (NIH), PubMed, RIFM, IFRA. Last reviewed: Apr 2026.
Report a data errorIngredient Data Sheet
CAS 83926-73-2Physical Properties
| Molecular Weight | 170.29 g/mol🔬 PubChem |
| LogP (Octanol-Water) | 3.6🔬 PubChem |
| Boiling Point | 238 °C🔬 EPA CompTox |
| Vapor Pressure | 0.0339 mmHg @ 25°C📊 OPERA |
| Flash Point | 94.5 °C🔬 EPA CompTox |
| Involatility Index | 0.0028💻 Calculated |
| log Kp (skin permeability) | -1.183💻 Calculated |
| SMILES | CC(C)(CCC1CCCCC1)O🔬 PubChem |
Volatility & Performance
| Fragrance Note | Heart💻 Calculated |
| Volatility Class | Very slow💻 Calculated |
| Persistence Score | 2.8 / 5💻 Calculated |
Odor & Flavor
| Primary Descriptors | muskywoody• leffingwell |
| Functional Groups | alcohol💻 RDKit |
Physical data: PubChem (NIH/NLM), U.S. EPA CompTox Dashboard, EPA OPERA models, RDKit. Odor & flavor: Arctander (Perfume & Flavor Chemicals), Fenaroli's Handbook of Flavor Ingredients, Leffingwell. Thresholds: van Gemert (Compilations of Odour Threshold Values). Regulatory: IFRA Standards 51st, FEMA GRAS. Trade names: Surburg (Common Fragrance & Flavor Materials). All data compiled and cross-referenced for perfumertools.com.
Physicochemical Properties
DTXSID: DTXSID9051402
Physical Properties
| Molecular Weight | 170.296 g/mol🔬 EPA CompTox |
| Density | 0.89 g/cm^3📊 OPERA |
| Boiling Point | 224.926 °C📊 OPERA |
| Melting Point | 51.206 °C📊 OPERA |
| Flash Point | 93.474 °C📊 OPERA |
| Refractive Index | 1.461 Dimensionless📊 OPERA |
| Molar Volume | 191.1 cm^3/mol📊 OPERA |
Partition & Solubility
| LogP (Octanol-Water) | 3.463 Log10 unitless📊 OPERA |
| LogD (pH 5.5) | 3.463 Log10 unitless📊 OPERA |
| LogD (pH 7.4) | 3.463 Log10 unitless📊 OPERA |
| LogKoa (Octanol-Air) | 7.71 Log10 unitless📊 OPERA |
| Water Solubility | 0.002 mol/L📊 OPERA |
| Henry's Law Constant | 0 atm-m3/mole📊 OPERA |
Transport Properties
| Vapor Pressure | 0.024 mmHg📊 OPERA |
| Viscosity | 20.881 cP📊 OPERA |
| Surface Tension | 31.504 dyn/cm📊 OPERA |
| Thermal Conductivity | 139.98 mW/(m*K)📊 OPERA |
Molecular Descriptors
| Topological Polar Surface Area | 20.23 Ų💻 Computed |
| H-Bond Donors | 1 count💻 Computed |
| H-Bond Acceptors | 1 count💻 Computed |
| Rotatable Bonds | 3 count💻 Computed |
| Aromatic Rings | 0 count💻 Computed |
| Molar Refractivity | 52.396 cm^3/mol📊 OPERA |
| Polarizability | 20.772 Å^3📊 OPERA |
Data Sources:
🔬 EPA Experimental data from U.S. EPA CompTox Chemicals Dashboard & CTX APIs. 📊 OPERA Predicted using EPA's OPERA QSAR models. 💻 Computed Calculated from SMILES using RDKit.
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