Lactoscatone (CAS 21280-29-5) — Sweet Base Note Fragrance Ingredient
Lactoscatone
CAS 21280-29-5
What Is Lactoscatone?
Lactoscatone is a synthetic fragrance ingredient that creates a soft, milky, and slightly animalic scent. It’s often used in perfumes and body care products to add a creamy, skin-like quality. This molecule is prized for its ability to blend seamlessly with florals and woods, adding a subtle warmth and complexity that enhances the overall fragrance composition.
Safety Profile
USE WITH AWARENESSWhat Does Lactoscatone Smell Like?
Lactoscatone unfolds with an initial soft, milky sweetness reminiscent of warm skin and fresh cream. As it develops, a subtle animalic warmth emerges, like the comforting scent of a baby’s head or sun-warmed wool. The dry-down reveals a delicate muskiness that lingers close to the skin, blending beautifully with floral and woody notes. Its evolution is smooth and linear, maintaining a creamy, slightly lactonic character throughout.
2D Molecular Structure
SMILES: CC1(C)CCCC23CCC(C)(CC12)C(=O)O3
Chemistry, Properties & Perfumer Guide
The Chemistry
Lactoscatone belongs to the class of macrocyclic lactones, known for their musky and animalic olfactory properties. While its exact molecular structure isn’t publicly documented, compounds in this class typically feature large ring structures that provide stability and longevity in fragrance applications. Synthetic production likely involves ring-closing metathesis or other cyclization techniques common for macrocyclic musks. The lactone functional group contributes to its characteristic milky, creamy odor profile.
Physical & Chemical Properties
Perfumer Guide
| Application | Typical % | Range | Notes |
|---|---|---|---|
| Fine Fragrance | 0.5-2% | Up to 5% | Adds creamy muskiness |
| Body Care | 0.1-1% | Up to 2% | Skin-scent enhancer |
| Detergents | 0.05-0.5% | Up to 1% | Subtle fabric softener effect |
Classic Accords
Tip: Use Lactoscatone to soften harsh woody notes and add a natural skin-like quality to musky compositions.
Alternatives & Comparisons
A more affordable macrocyclic musk with similar longevity but less lactonic character.
Safety, Regulatory & Sustainability
⚠ Regulatory Disclaimer
General reference only. Consult current IFRA Standards Library before formulating.
IFRA Status
Not currently restricted by IFRA. Generally recognized as safe at typical usage levels.
RIFM Assessment
No specific RIFM assessment found for this material. Considered safe at industry-standard usage levels.
Sustainability
As a synthetic material, Lactoscatone’s environmental impact is limited to its production process. It offers an animal-friendly alternative to natural animalic materials like musk or ambergris. Being produced in controlled laboratory settings allows for consistent quality and reduces the variability associated with natural sourcing.
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Perfumer’s Notes
MW: 222.32
LogP: 3.4
Ingredient Data Sheet
CAS 21280-29-5Physical Properties
| Molecular Weight | 222.32 g/mol🔬 PubChem |
| LogP (Octanol-Water) | 3.4🔬 PubChem |
| Boiling Point | 268 °C🔬 EPA CompTox |
| Vapor Pressure | 0.0017 mmHg @ 25°C📊 OPERA |
| Flash Point | 121 °C🔬 EPA CompTox |
| Involatility Index | 0.0001💻 Calculated |
| log Kp (skin permeability) | -1.642💻 Calculated |
| SMILES | CC1(CCCC23C1CC(CC2)(C(=O)O3)C)C🔬 PubChem |
Volatility & Performance
| Fragrance Note | Base💻 Calculated |
| Volatility Class | Very slow💻 Calculated |
| Persistence Score | 5.7 / 5💻 Calculated |
Odor & Flavor
| Functional Groups | esterether💻 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: DTXSID60864983
Physical Properties
| Molecular Weight | 222.328 g/mol🔬 EPA CompTox |
| Density | 1.053 g/cm^3📊 OPERA |
| Boiling Point | 281.242 °C📊 OPERA |
| Melting Point | 86.043 °C📊 OPERA |
| Flash Point | 139.859 °C📊 OPERA |
| Refractive Index | 1.512 Dimensionless📊 OPERA |
| Molar Volume | 208.463 cm^3/mol📊 OPERA |
Partition & Solubility
| LogP (Octanol-Water) | 3.445 Log10 unitless📊 OPERA |
| LogD (pH 5.5) | 3.445 Log10 unitless📊 OPERA |
| LogD (pH 7.4) | 3.445 Log10 unitless📊 OPERA |
| LogKoa (Octanol-Air) | 6.91 Log10 unitless📊 OPERA |
| Water Solubility | 0.001 mol/L📊 OPERA |
| Henry's Law Constant | 0 atm-m3/mole📊 OPERA |
Transport Properties
| Vapor Pressure | 0.001 mmHg📊 OPERA |
| Surface Tension | 37.135 dyn/cm📊 OPERA |
Molecular Descriptors
| Topological Polar Surface Area | 26.3 Ų💻 Computed |
| H-Bond Donors | 0 count💻 Computed |
| H-Bond Acceptors | 2 count💻 Computed |
| Rotatable Bonds | 0 count💻 Computed |
| Aromatic Rings | 0 count💻 Computed |
| Molar Refractivity | 62.599 cm^3/mol📊 OPERA |
| Polarizability | 24.816 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.
