3,7-Dimethyl-7-methoxyoctan-2-ol (CAS 41890-92-0) — Woody Middle Note Fragrance Ingredient

Woody · Citrus

3,7-Dimethyl-7-methoxyoctan-2-ol

CAS 41890-92-0

Origin
synthetic
Note
Middle
IFRA
Generally safe
Data as of: Apr 2026

What Is 3,7-Dimethyl-7-methoxyoctan-2-ol?

3,7-Dimethyl-7-methoxyoctan-2-ol is a synthetic fragrance ingredient used in perfumes and personal care products to add a fresh, woody character. It’s commonly found in fine fragrances, body washes, and air fresheners. This molecule matters because it helps create modern, clean scent profiles that are popular in contemporary perfumery, often serving as a subtle modifier to enhance other notes without overpowering them.

Safety Profile

GENERALLY SAFE
Generally safeUse with awarenessProfessional use
No major restrictions
Limited toxicology data available
CAS
41890-92-0
Formula
Mixture
MW
Variable
Odor Family
Woody · Citrus
Layer 1 · Enthusiast

What Does 3,7-Dimethyl-7-methoxyoctan-2-ol Smell Like?

This synthetic molecule offers a crisp, clean woody note with subtle citrus undertones. It opens with a faintly metallic freshness that quickly settles into a smooth, slightly sweet woodiness reminiscent of freshly sanded cedar. The dry-down reveals a soft, musky base that lingers close to the skin. It behaves like a chameleon in blends – amplifying citrus top notes while providing subtle structure to floral heart notes.

Scent Profile

In Famous Fragrances

Fragrance associations may not reflect actual formulations.

Wood Sage & Sea Salt(Jo Malone, 2014)

Used here to create the crisp woody facet that complements the marine notes, providing structure without heaviness.

Bleu de Chanel(Chanel, 2010)

Contributes to the modern woody-ambery signature, helping bridge the citrus top to woody base notes.

Layer 2

2D Molecular Structure

7-Methoxy-3,7-dimethyloctan-2-ol

SMILES: COC(C)(C)CCCC(C)C(C)O

Chemistry, Properties & Perfumer Guide

The Chemistry

3,7-Dimethyl-7-methoxyoctan-2-ol belongs to the family of branched aliphatic alcohols. While not found in nature, it shares structural similarities with some terpenoid compounds. Industrial synthesis typically involves Grignard reactions or hydroformylation of suitable precursors. The methoxy group at position 7 contributes to its unique odor profile and stability.

Physical & Chemical Properties

AppearanceColorless liquid
Boiling Point~220°C (estimated)
Density~0.89 g/cm³ (estimated)

Perfumer Guide

Note Position
Middle
Volatility
Medium (2-4 hours)
Blending
Good
ApplicationTypical %RangeNotes
Fine Fragrance1-5%Up to 8%Provides woody freshness
Functional Products0.1-1%Up to 2%Used in detergents for clean scent

Classic Accords

Tip: Use with citrus top notes to prevent sharpness and with woody bases to add lift.

Alternatives & Comparisons

1
Timberol CAS 28219-61-6

More pronounced woody character with less freshness. Better for oriental compositions.

Layer 3

Safety, Regulatory & Sustainability

⚠ Regulatory Disclaimer

General reference only. Consult current IFRA Standards Library before formulating.

IFRA Status

No IFRA restrictions currently apply to this material.

RIFM Assessment

Under evaluation by RIFM. Preliminary data suggests low sensitization potential.

Sustainability

As a synthetic material, production can be optimized for minimal environmental impact. Being petroleum-derived, carbon footprint considerations apply, but its potency means relatively small quantities are needed in formulations.

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References

  1. Bauer et al. (2001). Common Fragrance and Flavor Materials.

Data: PubChem (NIH), PubMed, RIFM, IFRA. Last reviewed: Apr 2026.

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Physicochemical Properties

DTXSID: DTXSID5052090

Physical Properties

Molecular Weight 188.311 g/mol🔬 EPA CompTox
Density 0.854 g/cm^3📊 OPERA
Boiling Point 228.243 °C📊 OPERA
Melting Point -25.514 °C📊 OPERA
Flash Point 73.6 °C📊 OPERA
Refractive Index 1.436 Dimensionless📊 OPERA
Molar Volume 214.78 cm^3/mol📊 OPERA

Partition & Solubility

LogP (Octanol-Water) 2.658 Log10 unitless📊 OPERA
LogD (pH 5.5) 2.658 Log10 unitless📊 OPERA
LogD (pH 7.4) 2.658 Log10 unitless📊 OPERA
LogKoa (Octanol-Air) 7.5 Log10 unitless📊 OPERA
Water Solubility 0.038 mol/L📊 OPERA
Henry's Law Constant 0 atm-m3/mole📊 OPERA

Transport Properties

Vapor Pressure 0.018 mmHg📊 OPERA
Viscosity 12.04 cP📊 OPERA
Surface Tension 27.312 dyn/cm📊 OPERA
Thermal Conductivity 138.918 mW/(m*K)📊 OPERA

Molecular Descriptors

Topological Polar Surface Area 29.46 Ų💻 Computed
H-Bond Donors 1 count💻 Computed
H-Bond Acceptors 2 count💻 Computed
Rotatable Bonds 6 count💻 Computed
Aromatic Rings 0 count💻 Computed
Molar Refractivity 56.174 cm^3/mol📊 OPERA
Polarizability 22.269 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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