NOAEL Data REACH Registered Cosmetic Ingredient

2-Octanone

Also known as: 2-Oxooctane, Hexyl methyl ketone, Methyl hexyl ketone, 4-01-00-03339, BRN 0635843 (+5 more)

CAS 111-13-7

2-Octanone (CAS 111-13-7) is a chemical substance. Key regulatory status: REACH registered, 7 regulatory/inventory lists, cosmetic ingredient cross-reference; source data from EPA ToxValDB, EPA CPDat, AICIS, ECHA REACH.

View cosmetic safety profile for Hexyl Methyl Ketone →

SOURCE NOAEL studies
NOAEL studies
10
SOURCE Chemical inventory jurisdictions
Regulatory lists
7
SOURCE EU CLP Annex VI
GHS signal
Not classified

Chemical Identity

CAS, identifiers, formula, and alternate names for the matched substance record.

SOURCE DSSTox identifiers 15 fields
Name
2-Octanone
CAS Number
111-13-7
Molecular Formula
C8H16O
InChI Key
ZPVFWPFBNIEHGJ-UHFFFAOYSA-N
Monoisotopic Mass
128.120115
Synonyms
2-OxooctaneHexyl methyl ketoneMethyl hexyl ketone4-01-00-03339BRN 0635843EINECS 203-837-1FEMA No. 2802FEMA Number 2802UNII-J2G84H29AFFEMA 2802

Functional Uses

Industrial and product-use categories associated with this substance.

SOURCE EPA CPDat 40 records
FragranceFlavouring and nutrient

Regulatory Lists

Inventory, screening, and regulatory list matches from public chemical databases.

SOURCE EPA CPDat 7 records
ListKeywordSource
air; detected; emissions; Europe; Toys and children's productsDanish Environmental Protection AgencyDanish EPA
artificial_sweat; detected; emissions; Europe; Toys and children's productsDanish Environmental Protection AgencyDanish EPA
artificial_sweat; detected; emissions; Europe; Toys and children's productsDanish Environmental Protection AgencyDanish EPA
IFRA TransparencyIFRAIFRA
food_additive; Substances Added to Food (formerly EAFUS) (2/2019)FDAUnited States Food and Drug Administration (FDA)
consumer_productP&GProctor & Gamble
EuropeEuropean CommissionFl@vis

NOAEL Studies

Toxicology endpoints rendered from public NOAEL study rows.

SOURCE NOAEL studies Showing 10 of 10 studies
ValueUnitEndpointRouteSpeciesSource
=1580mg/m3DNEL systemicinhalationHumanToxValDB GESTIS DNEL
=2.110e+4mg/m3DNEL systemicinhalationHumanToxValDB GESTIS DNEL
J2G84H29AFUNIIFDA UNII substance identifier--openFDA substances
0%Incidence of positive responsesDermalHumanNTP ICE skin sensitization
2592ug/cm2Induction dose per skin areaDermalHumanNTP ICE skin sensitization
>11.17mg/LLC50Inhalation-NTP ICE acute inhalation
=9mg/kg bwLD50oralRatNTP ICE acute oral
=3089mg/kg bwLD50oralRatNTP ICE acute oral
>5000mg/kg bwLD50oralRatNTP ICE acute oral
3unitlessRelative reliability scoreDermalHumanNTP ICE skin sensitization

Showing 10 of 10 studies

REACH Registration

Registration status from the ECHA REACH registered substances database.

SOURCE ECHA 1 records
StatusNameEC NumberLink
RegisteredOctan-2-one203-837-1ECHA overview →

Australian Status (AICIS)

Australian industrial chemicals inventory status and applicable conditions.

SOURCE AICIS inventory 1 records
Inventory Status
listed

Cosmetic Safety Profile

Same-CAS cosmetic ingredient record for cross-vertical context.

SOURCE CosIng / Ingredients DB
EU Status
permitted
Max
-
Category
Fragrance
View full cosmetic safety profile →

Pharmaceutical Data

Same-CAS pharmaceutical records from drug and bioactivity sources.

SOURCE ChEMBL / DailyMed CHEMBL18549
ChEMBL Phase
Not listed
Adverse Events
0
Bioactivity
0
View full pharmaceutical profile →

Food Safety Data

Same-CAS food additive, ADI, and GRAS records where available.

SOURCE EFSA 1 records

ADI: No safety concern at current levels of intake when used as a flavouring agent mg/kg bw

View full food safety profile →

Cannabis Data

Same-CAS cannabis compliance and lab records where available.

SOURCE Cannabis regulatory / lab data efsa substances

1 cannabis record found in efsa substances.

View full cannabis profile →

Frequently Asked Questions

What is the NOAEL for 2-Octanone?

2-Octanone has 10 NOAEL studies in the database. The lowest reported value is 0 % via Dermal in Human. Source: NTP ICE skin sensitization.

What regulatory lists include 2-Octanone?

2-Octanone appears on 6 regulatory/inventory lists including air; detected; emissions; Europe; Toys and children's products, artificial_sweat; detected; emissions; Europe; Toys and children's products, IFRA Transparency, and 3 more. Source: EPA CPDat.

Is 2-Octanone used in cosmetics?

Yes, 2-Octanone is also indexed as a cosmetic ingredient under the name Hexyl Methyl Ketone. View the full cosmetic safety profile on the ingredient page for detailed safety data, SCCS opinions, and regulatory status.

Where does the safety data for 2-Octanone come from?

Safety data is sourced from EPA ToxValDB, EPA CPDat, AICIS (Australian Industrial Chemicals Introduction Scheme), EPA DSSTox, ECHA REACH, CosIng / Ingredients DB, ChEMBL / DailyMed, EFSA / FDA GRAS, cannabis regulatory/lab databases. All data traces to primary regulatory sources and is updated from official government databases.

Is 2-Octanone used outside industrial chemicals?

2-Octanone also appears in cosmetics, pharmaceutical, food safety, cannabis databases.