EU/US Properties Organoleptics Cosmetics Suppliers Safety Safety in use Safety references References Other Blenders Uses Occurrence Synonyms Articles Notes
 

linalyl benzoate
benzoic acid, linalyl ester

Sponsors

Fragrance Demo Formulas
Name:3,7-dimethylocta-1,6-dien-3-yl benzoate
CAS Number: 126-64-7Picture of molecule3D/inchi
ECHA EINECS - REACH Pre-Reg:204-796-2
FDA UNII:2ADP7IT9Y3
Nikkaji Web:J60.347C
MDL:MFCD00048302
CoE Number:654
XlogP3-AA:5.00 (est)
Molecular Weight:258.36074000
Formula:C17 H22 O2
NMR Predictor:Predict (works with chrome or firefox)
EFSA/JECFA Comments:
Racemate.
Category:flavor and fragrance agents
 
US / EU / FDA / JECFA / FEMA / FLAVIS / Scholar / Patent Information:
Google Scholar:Search
Google Books:Search
Google Scholar: with word "volatile"Search
Google Scholar: with word "flavor"Search
Google Scholar: with word "odor"Search
Perfumer and Flavorist:Search
Google Patents:Search
US Patents:Search
EU Patents:Search
Pubchem Patents:Search
PubMed:Search
NCBI:Search
JECFA Food Flavoring:859 linalyl benzoate
FLAVIS Number:09.771 (Old)
DG SANTE Food Flavourings:09.771 linalyl benzoate
FEMA Number:2638 linalyl benzoate
FDA:No longer provide for the use of these seven synthetic flavoring substances
FDA Mainterm: LINALYL BENZOATE
FDA Regulation:
FDA PART 172 -- FOOD ADDITIVES PERMITTED FOR DIRECT ADDITION TO FOOD FOR HUMAN CONSUMPTION
Subpart F--Flavoring Agents and Related Substances
Sec. 172.515 Synthetic flavoring substances and adjuvants.
 
Physical Properties:
Appearance:yellow to brownish clear liquid (est)
Assay: 95.00 to 100.00
Food Chemicals Codex Listed: No
Specific Gravity:0.98000 to 0.99100 @ 25.00 °C.
Pounds per Gallon - (est).: 8.155 to 8.246
Refractive Index:1.50700 to 1.51000 @ 20.00 °C.
Boiling Point: 263.00 °C. @ 760.00 mm Hg
Acid Value: 2.00 max. KOH/g
Vapor Pressure:0.000047 mm/Hg @ 25.00 °C. (est)
Flash Point: 208.00 °F. TCC ( 97.78 °C. )
logP (o/w): 5.745 (est)
Soluble in:
 alcohol
 water, 0.218 mg/L @ 25 °C (est)
Insoluble in:
 water
Stability:
 shampoo
 soap
 
Organoleptic Properties:
Odor Type: floral
Odor Strength:medium
Substantivity:12 hour(s) at 100.00 %
tuberose genet bergamot lily herbal
Odor Description:at 100.00 %. broom tuberose genet bergamot lily heather
Flavor Type: floral
floral
Taste Description: floral
Odor and/or flavor descriptions from others (if found).
Givaudan
Linalyl Benzoate
Odor Description:Floral, Tuberose
Linalyl Benzoate has a beautiful floral, tuberose character. It blends extremely well in oriental and floral types where its use gives warmth and softness.
Sigma-Aldrich
Linalyl benzoate, ≥95%
Odor Description:gardenia; jasmine
 
Cosmetic Information:
CosIng:cosmetic data
Cosmetic Uses: perfuming agents
 
Suppliers:
BOC Sciences
For experimental / research use only.
Linalyl Benzoate
CG Herbals
Linalyl Benzoate
Odor: Floral, Tuberose-like
Use: Linalyl Benzoate has a beautiful floral, tuberose character. It blends extremely well in oriental and floral types where its use gives warmth and softness.
Fleurchem
linalyl benzoate
Givaudan
Linalyl Benzoate
Odor: Floral, Tuberose
Use: Linalyl Benzoate has a beautiful floral, tuberose character. It blends extremely well in oriental and floral types where its use gives warmth and softness.
Lluch Essence
LINALYL BENZOATE
Moellhausen
LINALYL BENZOATE
Penta International
LINALYL BENZOATE, Kosher
Sigma-Aldrich
Linalyl benzoate, ≥95%
Odor: gardenia; jasmine
Certified Food Grade Products
Vigon International
Linalyl Benzoate
Odor: Floral, Tuberose
 
Safety Information:
Preferred SDS: View
European information :
Most important hazard(s):
None - None found.
S 02 - Keep out of the reach of children.
S 24/25 - Avoid contact with skin and eyes.
 
Hazards identification
 
Classification of the substance or mixture
GHS Classification in accordance with 29 CFR 1910 (OSHA HCS)
None found.
GHS Label elements, including precautionary statements
 
Pictogram
 
Hazard statement(s)
None found.
Precautionary statement(s)
None found.
Oral/Parenteral Toxicity:
oral-rat LD50 > 5000 mg/kg
Food and Cosmetics Toxicology. Vol. 14, Pg. 461, 1976.

Dermal Toxicity:
skin-rabbit LD50 > 5000 mg/kg
Food and Cosmetics Toxicology. Vol. 14, Pg. 461, 1976.

Inhalation Toxicity:
Not determined
 
Safety in Use Information:
Category: flavor and fragrance agents
Recommendation for linalyl benzoate usage levels up to:
  8.0000 % in the fragrance concentrate.
 
Maximised Survey-derived Daily Intakes (MSDI-EU): 8.40 (μg/capita/day)
Maximised Survey-derived Daily Intakes (MSDI-USA): 2.00 (μg/capita/day)
Structure Class: I
Use levels for FEMA GRAS flavoring substances on which the FEMA Expert Panel based its judgments that the substances are generally recognized as safe (GRAS).
The Expert Panel also publishes separate extensive reviews of scientific information on all FEMA GRAS flavoring substances and can be found at FEMA Flavor Ingredient Library
publication number: 3
 average usual ppmaverage maximum ppm
baked goods: -1.60000
beverages(nonalcoholic): -0.31000
beverages(alcoholic): --
breakfast cereal: --
cheese: --
chewing gum: --
condiments / relishes: --
confectionery froastings: --
egg products: --
fats / oils: --
fish products: --
frozen dairy: -0.42000
fruit ices: -0.42000
gelatins / puddings: -0.28000
granulated sugar: --
gravies: --
hard candy: -1.20000
imitation dairy: --
instant coffee / tea: --
jams / jellies: --
meat products: --
milk products: --
nut products: --
other grains: --
poultry: --
processed fruits: --
processed vegetables: --
reconstituted vegetables: --
seasonings / flavors: --
snack foods: --
soft candy: --
soups: --
sugar substitutes: --
sweet sauces: --
 
Safety References:
European Food Safety Athority(efsa):Flavor usage levels; Subacute, Subchronic, Chronic and Carcinogenicity Studies; Developmental / Reproductive Toxicity Studies; Genotoxicity Studies...

European Food Safety Authority (EFSA) reference(s):

Flavouring Group Evaluation 54 (FGE.54)[1] - Consideration of benzyl derivatives evaluated by JECFA (57th meeting) structurally related to benzyl alcohols, benzaldehydes, a related acetal, benzoic acids and related esters evaluated by EFSA in FGE.20 (2005) - Scientific Opinion of the Panel on Food Additives, Flavourings, Processing Aids and Materials in Contact with Food
View page or View pdf

Flavouring Group Evaluation 54, Revision 1 (FGE.54Rev1): Consideration of benzyl derivatives evaluated by JECFA (57th meeting) structurally related to benzyl alcohols, benzaldehydes, a related acetal, benzoic acids and related esters evaluated by EFSA in FGE.20Rev1 (2009)
View page or View pdf

EPI System: View
EPA Substance Registry Services (TSCA):126-64-7
EPA ACToR:Toxicology Data
EPA Substance Registry Services (SRS):Registry
Laboratory Chemical Safety Summary :31353
National Institute of Allergy and Infectious Diseases:Data
WGK Germany:2
3,7-dimethylocta-1,6-dien-3-yl benzoate
Chemidplus:0000126647
RTECS:DH3300000 for cas# 126-64-7
 
References:
 3,7-dimethylocta-1,6-dien-3-yl benzoate
NIST Chemistry WebBook:Search Inchi
Canada Domestic Sub. List:126-64-7
Pubchem (cid):31353
Pubchem (sid):134973714
 
Other Information:
(IUPAC):Atomic Weights of the Elements 2009
(IUPAC):Atomic Weights of the Elements 2009 (pdf)
Videos:The Periodic Table of Videos
tgsc:Atomic Weights use for this web site
(IUPAC):Periodic Table of the Elements
FDA Everything Added to Food in the United States (EAFUS):View
CHEMBL:View
HMDB (The Human Metabolome Database):HMDB30431
FooDB:FDB002295
VCF-Online:VCF Volatile Compounds in Food
ChemSpider:View
 
Potential Blenders and core components note
For Odor
aldehydic
citronellyl oxyacetaldehyde
FL/FR
2-
methyl undecanal (aldehyde C-12 mna)
FL/FR
muguet undecadienal
FR
citrus
benzyl anthranilate
FR
bergamot acetoacetate
FR
beta-
bisabolol
FL/FR
(Z)-4-
decenal
FL/FR
dihydromyrcenyl acetate
FR
alpha-
methylene citronellal
FR
myrcenyl acetate
FL/FR
myrmac aldehyde
FR
alpha-
terpinyl methyl ether
FL/FR
tetrahydromyrcenol
FR
floral
amyl cyclopentenone
CS
iso
amyl salicylate
FL/FR
boronia butenal
FR
butyl tiglate
FR
(S)-
citronellyl acetate
FL/FR
citronellyl ethoxalate
FR
citronellyl formate
FL/FR
cumin carbinol
FR
cyclamen homoaldehyde
FR
cyclohexyl propanol
FR
2-
decalinol
FR
2,4-
dimethyl-3-cyclohexene-1-methanol
FR
ethyl linalool
FR
ethyl linalyl acetal
FR
ethyl ortho-anisate
FL/FR
(E,E)-
farnesol
FL/FR
floral butanal
FR
floral pyranol
FR
floral specialty
FR
hawthorn ethanol
FR
(Z)-4-
hepten-2-yl salicylate
FR
herbal pyran
FR
hydroxycitronellal diethyl acetal
FL/FR
hydroxycitronellal distillation residue distillates
FR
hydroxycitronellal nitrile
FR
hydroxycitronellal propylene glycol acetal
FL/FR
hydroxycitronellal residue
FR
jasimia
FR
jasmin lactone (IFF)
FL/FR
para-
jasmone
FR
karo karounde absolute
FR
abrialis
lavandin oil
FL/FR
lavandula angustifolia flower oil
FL/FR
lavender oil france
FL/FR
lavender oil greece
FL/FR
leerall
FR
calla
lily fragrance
FR
lily of the valley specialty
FR
lilyall
FR
lilyall / methyl anthranilate schiff's base
FR
linalyl butyrate
FL/FR
linalyl propionate
FL/FR
magnolia cyclohexanol
FR
magnolia decadienal
FR
methoxycitronellal
FR
2-
methyl octanal
FL/FR
1-
methyl-3-(2-methyl propyl) cyclohexanol
FR
3-
methyl-6-ethyl-5-octen-1-ol
FR
mimusops elengi flower oil CO2 extract
FR
muguet butanal
FR
muguet butanol
FR
muguet carboxaldehyde
FR
muguet ethanol
FR
muguet nitrile
FR
muguet octadienol
FR
muguet propanol
FR
muguet shiseol
FL/FR
muguet specialty
FR
neryl isovalerate
FL/FR
(Z)-beta-
ocimene
FL/FR
octahydro-4,7-methano-1H-indene-5-acetaldehyde
FR
phenyl glycol diacetate
FR
iso
phytol
FL/FR
prenyl salicylate
FL/FR
terpinyl isobutyrate
FL/FR
tetrahydrolinalyl acetate
FR
tuberolide
FL/FR
tuberose acetate
FR
fruity
linalyl isobutyrate
FL/FR
nerolidyl isobutyrate
FR
ocimen-1-yl acetate
FR
green
iso
butyl benzyl carbinol
FL/FR
iso
green methanoindene
FR
heptyl formate
FL/FR
laevo-
linalyl acetate
FL/FR
dextro-
linalyl acetate
FL/FR
phenyl acetaldehyde diethyl acetal
FL/FR
herbal
bergamot mint herb oil
FR
carrot seed oil (daucus carota ssp. gummifer hook. fil.) spain
FR
chamomile isobutyrate
FR
cuminyl acetate
FL/FR
dimethyl benzyl carbinyl formate
FL/FR
lavender absolute bulgaria
FL/FR
lavender stem oil lithuania
FR
linalyl acetate
FL/FR
linalyl formate
FL/FR
linalyl isovalerate
FL/FR
myrtle oil
FL/FR
3-
octyl acetate
FL/FR
terpineol acetate
FL/FR
minty
iso
pulegyl formate
FL/FR
woody
cyperus root oil (cyperus rotundus)
FR
2-
decalinyl acetate
FR
alpha-
farnesene
FL/FR
hydroxycitronellal diisotridecyl acetal
FR
For Flavor
No flavor group found for these
cuminyl acetate
FL/FR
dimethyl benzyl carbinyl formate
FL/FR
ethyl ortho-anisate
FL/FR
(E,E)-
farnesol
FL/FR
hydroxycitronellal propylene glycol acetal
FL/FR
jasmin lactone (IFF)
FL/FR
dextro-
linalyl acetate
FL/FR
laevo-
linalyl acetate
FL/FR
linalyl formate
FL/FR
2-
methyl octanal
FL/FR
phenyl acetaldehyde diethyl acetal
FL/FR
iso
pulegyl formate
FL/FR
terpineol acetate
FL/FR
terpinyl isobutyrate
FL/FR
amber
amber
iso
butyl benzyl carbinol
FL/FR
citrus
beta-
bisabolol
FL/FR
citronellyl oxyacetaldehyde
FL/FR
(Z)-4-
decenal
FL/FR
myrcenyl acetate
FL/FR
fatty
heptyl formate
FL/FR
floral
(S)-
citronellyl acetate
FL/FR
linalyl acetate
FL/FR
linalyl butyrate
FL/FR
linalyl isobutyrate
FL/FR
muguet shiseol
FL/FR
fruity
citronellyl formate
FL/FR
linalyl isovalerate
FL/FR
neryl isovalerate
FL/FR
green
iso
amyl salicylate
FL/FR
alpha-
farnesene
FL/FR
(Z)-beta-
ocimene
FL/FR
3-
octyl acetate
FL/FR
herbal
abrialis
lavandin oil
FL/FR
lavandula angustifolia flower oil
FL/FR
lavender absolute bulgaria
FL/FR
lavender oil france
FL/FR
lavender oil greece
FL/FR
linalyl propionate
FL/FR
prenyl salicylate
FL/FR
melon
hydroxycitronellal diethyl acetal
FL/FR
oily
iso
phytol
FL/FR
spicy
myrtle oil
FL/FR
waxy
2-
methyl undecanal (aldehyde C-12 mna)
FL/FR
tuberolide
FL/FR
woody
alpha-
terpinyl methyl ether
FL/FR
 
Potential Uses:
FRbergamot
 erica
 fixer
FRfloral
FRfresh outdoors
FRgardenia
FRgenet
 gorse
FRheather
FRjasmin
FRlily
FRoriental
FRtuberose
 tweed
FRylang ylang
 
Occurrence (nature, food, other):note
 mushroom
Search PMC Picture
 tuberose oils
Search Trop Picture
 ylang ylang oil
Search Trop Picture
 
Synonyms:
 benzoic acid linalool ester
 benzoic acid linalyl ester
 benzoic acid, linalyl ester
1,5-dimethyl-1-vinyl hex-4-enyl benzoate
1,5-dimethyl-1-vinyl-4-hexen-1-yl benzoate
1,5-dimethyl-1-vinylhex-4-enyl benzoate
3,7-dimethyl-1, 6-octadien-3-yl benzoate
3,7-dimethyl-1,6-octadien-3-yl benzoate
3,7-dimethylocta-1,6-dien-3-yl benzoate
4-hexen-1-ol, 1,5-dimethyl-1-vinyl-, benzoate
 linalol benzoate
 linalool benzoate
 linalool, benzoate
 linalylbenzoate
1,6-octadien-3-ol, 3,7-dimethyl-, benzoate
 
 
Notes:
Blends well with floral and oriental notes. Found in ylang-ylang and tuberose essential oils and mushrooms. Used in perfumery and food flavouring
Please share your Comments.
Email Address:
Top of Page Home
Copyright © 1980-2018 The Good Scents Company (tgsc) ™ Disclaimer Privacy Policy