(S)-citronellyl acetate

(3S)-3,7-dimethyl-6-octen-1-yl acetate

CAS: 67601-05-2 C12 H22 O2 MW: 198.30574000 floral floral

Identification

Name	(S)-citronellyl acetate
IUPAC	[(3S)-3,7-dimethyloct-6-enyl] acetate
CAS Number	67601-05-2
EINECS	266-767-0
FDA UNII	78RZL4H51H
Molecular Formula	C12 H22 O2
Molecular Weight	198.30574000
Nikkaji Number	J67.960G

Regulatory

FDA Mainterm (SATF)	LAEVO-CITRONELLYL ACETATE
FDA Regulation	FDA PART 172 -- FOOD ADDITIVES PERMITTED FOR DIRECT ADDITION TO FOOD FOR HUMAN CONSUMPTION

Physical Properties

Appearance	colorless clear liquid (est)
Assay	98.00 to 100.00
Food Chemicals Codex Listed	No
Specific Gravity	0.88500 to 0.89500 @ 25.00 °C.
Pounds per Gallon - (est).	7.364 to 7.447
Refractive Index	1.44100 to 1.44500 @ 20.00 °C.
Boiling Point	118.00 to 122.00 °C. @ 15.00 mm Hg, 258.00 to 259.00 °C. @ 760.00 mm Hg
Acid Value	1.00 max. KOH/g
Vapor Pressure	0.010000 mmHg @ 20.00 °C.
Flash Point	240.00 °F. TCC ( 115.56 °C. )
logP (o/w)	4.280
Soluble in	alcohol

Organoleptic Properties

Odor Strength	medium
Substantivity	8 hour(s) at 100.00 %
Odor Description	at 100.00 %. Fresh-rosy-fruity
Odor sample from	Takasago International Corp
Taste Description	floral green waxy apple fruity pear soapy

Safety Information

European information	Most important hazard(s):
Oral/Parenteral Toxicity	oral-rat LD50 6800 mg/kg
Dermal Toxicity	skin-rabbit LD50 > 2000 mg/kg
Inhalation Toxicity	Not determined

GHS Classification

['GHS Classification in accordance with 29 CFR 1910 (OSHA HCS)', 'GHS Label elements, including precautionary statements']

Safety in Use

Category	flavor and fragrance agents
RIFM Fragrance Material Safety Assessment	Search
Recommendation for (S)-citronellyl acetate usage levels up to	15.0000 % in the fragrance concentrate.
Maximised Survey-derived Daily Intakes (MSDI-EU)	190.00 (μg/capita/day)

Foreverest Resources Ltd.

Leading pine based chemicals supplier

Supplying turpentine based and natural/extracted flavor & fragrance ingredients.

Citronellyl Acetate 98%

View All Website +86 (0)592 5105533 info@foreverest.cn

SRS Aromatics Ltd

For over 25 years

Bringing flavour and fragrance into your world.

CITRONELLYL ACETATE LAEVO (FG)

View All Website +44 (0) 1284 704076 info@srsaromatics.co.uk

Potential Uses

FR abronia FR agrumen aldehyde FR aldehydic FR angel essence FR apple FR apple blossom FR crabapple FR apple green apple FR apple red apple FR apricot FR banana FR bergamot FR berry blossom tropical blossom FR blueberry FR boysenberry FR calamus oil replacer FR carnation FR cedrat FR cherry black cherry FR cherry blossom FL cherry wild cherry FR chestnut blossom FR chrysanthemum FR citronella FR citrus FR clary sage oil replacer FR clover FR coconut tropical coconut FR cologne FR colonia FL/FR coriander FR cortex FR crabapple blossom FR cranberry FR cucumber FL curacao FR cyclamen FR fern FR floral FR florida breeze FR foliage FR forest FR freesia FR geranium FR gooseberry FR grape FR grapefruit FR green FR green grass FR green leaf FR greenhouse FR hay new mown hay FR honey FR hydrangea FR ivy FR jasmin FR kiwi blossom FR kumquat FR lavender FR lemon FL lettuce FR lily FR lily of the valley FR linden flower FR lychee FR magnolia FR mango FR mango flower FR melissa oil replacer FR mint FR mock orange FL necterine FR neroli FR ocean sea FR orange FR orchid FR papaya FR passion fruit FR peach FR pear FL pear prickly pear FR peony FR floral FR petitgrain FR plum FR pomegranate FR potpourri FR quince FR rain FR rhubarb FR rose FR rose moss rose FR rose red rose FR rose white rose rose wild rose FR spring rain FR strawberry strawberry leaf FR sweet pea FR tangerine FL tea FR tomato leaf FR tulip FR verbena FR woodruff

Natural Occurrence

citronella oil PMC geranium oil lemon oil

Synonyms

(3S)-(-)- citronellyl acetate L- citronellyl acetate laevo- citronellyl acetate (-)-3,7- dimethyl oct-6-enyl acetate (3S)-3,7- dimethyl-6-octen-1-ol acetate (3S)-3,7- dimethyl-6-octen-1-yl acetate [(3S)-3,7- dimethyloct-6-enyl] acetate 6- octen-1-ol, 3,7-dimethyl-, acetate, (3S)- PubMed: Toxicity of Zanthoxylum piperitum and Zanthoxylum armatum oil constituents and related compounds to Stomoxys calcitrans (Diptera: Muscidae). PubMed: Biotransformation of menthol and geraniol by hairy root cultures of Anethum graveolens: effect on growth and volatile components. PubMed: Sensory and instrumental evaluation of catnip (Nepeta cataria L.) aroma.