NOAEL Data REACH Registered Cosmetic Ingredient

Citronellyl isobutyrate

Also known as: 3,7-Dimethyloct-6-enyl isobutyrate, Citronellyl 2-methylpropanoate, 3,7-Dimethyl-6-octenyl isobutyrate, 3,7-Dimethyl-6-octen-1-yl isobutyrate, 3,7-Dimethyl-6-octen-1-yl 2-methylpropanoate (+6 more)

CAS 97-89-2

Citronellyl isobutyrate (CAS 97-89-2) is a chemical substance. Key regulatory status: REACH registered, 3 regulatory/inventory lists, cosmetic ingredient cross-reference; source data from EPA ToxValDB, EPA CPDat, AICIS, ECHA REACH.

View cosmetic safety profile for Citronellyl Isobutyrate →

SOURCE noael studies public
NOAEL studies
7
SOURCE chemical inventory jurisdictions
Regulatory lists
3
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 17 fields
Name
Citronellyl isobutyrate
CAS Number
97-89-2
DTXSID
DTXSID7052652
Molecular Formula
C14H26O2
InChI Key
ZGPPERKMXSGYRK-UHFFFAOYSA-N
Monoisotopic Mass
226.19328
Synonyms
3,7-Dimethyloct-6-enyl isobutyrateCitronellyl 2-methylpropanoate3,7-Dimethyl-6-octenyl isobutyrate3,7-Dimethyl-6-octen-1-yl isobutyrate3,7-Dimethyl-6-octen-1-yl 2-methylpropanoate3,7-Dimethyl-6-octenyl methylpropionateEINECS 202-616-7FEMA No. 2313Isobutyric acid, 3,7-dimethyl-6-octenyl esterNSC 46148UNII-5RZR3JKW1P

Functional Uses

Industrial and product-use categories associated with this substance.

SOURCE EPA CPDat 4 records
FragranceFlavouring and nutrient

Regulatory Lists

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

SOURCE EPA CPDat 3 records
ListKeywordSource
IFRA TransparencyIFRAIFRA
EuropeEuropean CommissionFl@vis
food_additive; Substances Added to Food (formerly EAFUS) (2/2019)FDAUnited States Food and Drug Administration (FDA)

NOAEL Studies

Toxicology endpoints rendered from public NOAEL study rows.

SOURCE NOAEL studies Showing 7 of 7 studies
ValueUnitEndpointRouteSpeciesSource
5RZR3JKW1PUNIIFDA UNII substance identifier--openFDA substances
5RZR3JKW1PUNIIFDA UNII substance identifier--openFDA substances
5RZR3JKW1PUNIIFDA UNII substance identifier--openFDA substances
5RZR3JKW1PUNIIFDA UNII substance identifier--openFDA substances
-%Incidence of positive responsesDermalHumanNTP_ICE_skin_sensitization
2592ug/cm2Induction dose per skin areaDermalHumanNTP_ICE_skin_sensitization
3unitlessRelative reliability scoreDermalHumanNTP_ICE_skin_sensitization

Showing 7 of 7 studies

REACH Registration

Registration status from the ECHA REACH registered substances database.

SOURCE ECHA (EU) 1 records
StatusNameEC NumberLink
Registered3,7-dimethyloct-6-enyl isobutyrate202-616-7ECHA 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 →

Food Safety Data

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

SOURCE EFSA / FDA GRAS 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 →

Frequently Asked Questions

What is the NOAEL for Citronellyl isobutyrate?

Citronellyl isobutyrate has 7 NOAEL studies in the database. The lowest reported value is 5RZR3JKW1P UNII. Source: openFDA substances.

What regulatory lists include Citronellyl isobutyrate?

Citronellyl isobutyrate appears on 3 regulatory/inventory lists including IFRA Transparency, Europe, food_additive; Substances Added to Food (formerly EAFUS) (2/2019). Source: EPA CPDat.

Is Citronellyl isobutyrate used in cosmetics?

Yes, Citronellyl isobutyrate is also indexed as a cosmetic ingredient under the name Citronellyl Isobutyrate. 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 Citronellyl isobutyrate come from?

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

Is Citronellyl isobutyrate used outside industrial chemicals?

Citronellyl isobutyrate also appears in cosmetics, food safety databases.