Moderate Cosmetic Ingredient GHS Classified

Isopentanal

Also known as: Isovaleraldehyde, 4-01-00-03291, BRN 0773692, 1-Butanal, 3-methyl-, EINECS 209-691-5 (+15 more)

INCI: ISOPENTANAL

Isopentanal (CAS 590-86-3) is a cosmetic cosmetic ingredient functioning as Fragrance ingredient. EU Regulation 1223/2009 status: permitted; GHS signal word DANGER. Industrial safety data is also available in the chemical safety database. Same-CAS public records also appear in industrial chemical safety and pharmaceutical data.

View industrial chemical safety profile for CAS 590-86-3 →

Auto-generated CPSR Part A draft with source citations
Function
Fragrance ingredient
Safety Rating
MODERATE

Chemistry & Identifiers

Formula
C5H10O
MW
86.13 g/mol
EC Number
209-691-5
PubChem CID
11552
IUPAC Name
3-methylbutanal
InChIKey
YGHRJJRRZDOVPD-UHFFFAOYSA-N

Regulatory Status

EU EU Status permitted
US US Status permitted
US Notes Permitted — FEMA GRAS; no specific CFR restriction for cosmetic use

For full compliance data across multiple jurisdictions, use the Substance Compliance tool.

Safety Data

Margin of Safety, dermal absorption, and sensitization profile summaries for Isopentanal.

Calculate MoS for your specific formulation with the MoS Calculator.

GHS Hazard Classification

Globally Harmonized System classification per ECHA C&L inventory and ILO/WHO International Chemical Safety Cards.

Signal Word
DANGER
Pictograms
FlamFlameCancerHealth haz
Hazard Statements
Highly flammable liquid and vapour Causes mild skin irritation Causes eye irritation May be harmful if swallowed and enters airways Toxic to aquatic life
Short-term Exposure Effects
The substance is irritating to the eyes and respiratory tract. The substance is mildly irritating to the skin. If swallowed the substance may cause vomiting and could result in aspiration pneumonitis.

HRIPT Human Patch Test Studies

1 human repeat insult patch test aggregated from dermatological literature.

Test Type N Sensitized Dose µg/cm² NESIL µg/cm² Potency
HMT - 0 675 - -

ECHA REACH Registration

European Chemicals Agency REACH dossier and Substances of Very High Concern listing.

Registration Type
Full
Tonnage Band
1 - 10 tonnes
Substance Type
SUBSTANCE
SVHC Candidate
No

PubChem Annotations

Safety and regulatory annotations from PubChem (NCBI) aggregated sources.

Safety (2)
ICSC Safety Card
1748
Source: ILO-WHO International Chemical Safety Cards (ICSCs)
Skin Eye Respiratory Irritation
The low molecular weight aldehydes, the halogenated aliphatic aldehydes, and the unsaturated aldehydes are particularly irritating. /Aldehydes/
Source: Hazardous Substances Data Bank (HSDB)
Regulatory (3)
JECFA Number
258
Source: Joint FAO/WHO Expert Committee on Food Additives (JECFA)
JECFA Evaluation
3-METHYLBUTYRALDEHYDE | 1997 | No safety concern at current levels of intake when used as a flavouring agent | TRS 884-JECFA 49/37 | FAS 40-JECFA 49/189
Source: Joint FAO/WHO Expert Committee on Food Additives (JECFA)
JECFA Evaluation
ISOVALERALDEHYDE | 1997 | No safety concern at current levels of intake when used as a flavouring agent | TRS 884-JECFA 49/37 | FAS 40-JECFA 49/189
Source: Joint FAO/WHO Expert Committee on Food Additives (JECFA)

Function Categories & List Membership

Cosmetic/Chemical Function Categories
Deodorizer Flavouring and nutrient Fragrance
Regulatory List Membership (2)
IFRA Fragrance Transparency List FDA Substances Added to Food (EAFUS)

Expert Verdict

Expert safety assessment and concern-level summary for Isopentanal.

Regulatory Flags

fragrance-component ifra_fragrance fda_food_additive

Known Synonyms

Isovaleraldehyde 4-01-00-03291 BRN 0773692 1-Butanal, 3-methyl- EINECS 209-691-5 FEMA No. 2692 2-Methylbutanal-4 3-Methylbutylaldehyde beta-Methylbutyraldehyde Aldehyde isovalerianique UNII-69931RWI96 3-Methyl-Butanal 3-Methyl-Butyraldehyde 3-Methylbutan-1-al Isoamyl aldehyde Isopentaldehyde Isovalerylaldehyde Methyl butanal b-Methylbutanal beta-Methylbutanal

Chemical Function

Deodorizer Fragrance Flavouring and nutrient

Regulatory Lists

air; detected; emissions; Europe; Toys and children's products air; detected; emissions; Europe; Other direct contact consumer goods air; detected; emissions; Europe; Toys and children's products Europe IFRA Transparency food_additive; Substances Added to Food (formerly EAFUS) (2/2019)

Australian Status

AICIS status: listed

Cross-Vertical Safety Context

Same-CAS public records found in pharmaceutical data.

SOURCE ChEMBL / DrugCentral / FAERS DB_PHARMA CAS match

Pharmaceutical Data

Same-CAS rows from the pharmaceutical spoke database.

ChEMBL ID
CHEMBL18360
View full pharmaceutical profile →

Frequently Asked Questions

Is Isopentanal safe in cosmetics?

Isopentanal has a safety rating of "MODERATE" in our database. EU status: permitted. US status: permitted.

Is Isopentanal allowed in the EU?

Isopentanal EU regulatory status: permitted. This is based on EU Regulation 1223/2009 and its amendments.

What does Isopentanal do in cosmetics?

Isopentanal functions as: Fragrance ingredient. It is classified as a cosmetic ingredient in our database. CAS number: 590-86-3.

Is Isopentanal classified as hazardous under GHS?

Isopentanal carries a GHS signal word of "DANGER". Hazard statements: Highly flammable liquid and vapour Causes mild skin irritation Causes eye irritation May be harmful if swallowed and enters airways Toxic to aquatic life. This classification is based on the ILO/WHO International Chemical Safety Card and ECHA C&L inventory data. Note: GHS classification applies to the pure substance — at cosmetic use concentrations, hazard thresholds may not be met.

Is Isopentanal used outside cosmetics?

Isopentanal also appears in industrial chemical safety and pharmaceutical data. The cross-vertical cards on this page render same-CAS public rows from the matched databases.

Does Isopentanal have different safety status in cosmetics vs industrial chemicals?

Isopentanal is classified GHS Danger (H225, H317, H319, H335, H411, H315, H332) in the chemicals database but is allowed in EU cosmetics.

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