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

(-)-alpha-bisabolol
(2S)-6-methyl-2-[(1S)-4-methylcyclohex-3-en-1-yl]hept-5-en-2-ol

Supplier Sponsors

CAS Number: 23089-26-1Picture of molecule3D/inchi
Other(deleted CASRN):101467-45-2
ECHA EINECS - REACH Pre-Reg:245-423-3
FDA UNII: 24WE03BX2T
Nikkaji Web:J38.588C
MDL:MFCD03412455
XlogP3-AA:3.80 (est)
Molecular Weight:222.37142000
Formula:C15 H26 O
BioActivity Summary:listing
NMR Predictor:Predict (works with chrome, Edge or firefox)
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:2031 alpha-bisabolol
FEMA Number:4666 alpha-bisabolol
FDA:No longer provide for the use of these seven synthetic flavoring substances
 
Physical Properties:
Appearance:pale yellow clear oily liquid (est)
Assay: 93.00 to 100.00
Food Chemicals Codex Listed: No
Specific Gravity:0.92700 to 0.93500 @ 25.00 °C.
Pounds per Gallon - (est).: 7.714 to 7.780
Refractive Index:1.49300 to 1.49900 @ 20.00 °C.
Boiling Point: 314.00 °C. @ 760.00 mm Hg
Boiling Point: 151.00 to 152.00 °C. @ 12.00 mm Hg
Vapor Pressure:0.000040 mmHg @ 25.00 °C. (est)
Flash Point: 235.00 °F. TCC ( 112.78 °C. )
logP (o/w): 4.592 (est)
Soluble in:
 alcohol
 water, 1.688 mg/L @ 25 °C (est)
Insoluble in:
 water
 
Organoleptic Properties:
Odor Type: floral
fruity nutty coconut
Odor Description:at 100.00 %. fruity nutty coconut
Odor and/or flavor descriptions from others (if found).
 
Cosmetic Information:
CosIng:cosmetic data
Cosmetic Uses: fragrance
skin conditioning
soothing agents
 
Suppliers:
BOC Sciences
For experimental / research use only.
Levomenol
Ernesto Ventós
BISABOLOL ALPHA NATURAL
ExtraSynthese
For experimental / research use only.
alpha-(-)-Bisabolol (GC) ≥95%
Givaudan
BisaboLife™
Odor: characteristic
Use: BisaboLife™ contains (-)-a-bisabolol, one of the main compound of Matricaria recutita, known as Chamomile, an age-old medicinal herb used in ancient Egypt, Greece and Rome. It is well-know for its multiple biological benefits and its highly biodegradability.
Lluch Essence
ALPHA-BISABOLOL NATURAL
M&U International
NAT. BISABOLOL ALPHA
Penta International
ALPHA-BISABOLOL NATURAL
Penta International
ALPHA-BISABOLOL
Santa Cruz Biotechnology
For experimental / research use only.
(-)-a-Bisabolol
Sigma-Aldrich: Aldrich
For experimental / research use only.
(-)-a-Bisabolol ≥95% (GC)
Vigon International
BISABOLOL ALPHA NATURAL
 
Safety Information:
Preferred SDS: View
 
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:
Not determined
Dermal Toxicity:
Not determined
Inhalation Toxicity:
Not determined
 
Safety in Use Information:
Category:
flavor and fragrance agents
RIFM Fragrance Material Safety Assessment: Search
IFRA Code of Practice Notification of the 49th Amendment to the IFRA Code of Practice
IFRA Critical Effect:
Dermal sensitization and systemic toxicity
 View the IFRA Standard
View IFRA Standards Library for complete information.
Please review Amendment 49 IFRA documentation for complete information.
IFRA RESTRICTION LIMITS IN THE FINISHED PRODUCT (%):
Category 1: Products applied to the lips
0.42 %
Category 2: Products applied to the axillae
0.13 %
Category 3: Products applied to the face/body using fingertips
2.50 %
Category 4: Products related to fine fragrance
2.40 %
 Category 5: Products applied to the face and body using the hands (palms), primarily leave-on
Category 5A: Body lotion products applied to the body using the hands (palms), primarily leave-on
0.60 %
Category 5B: Face moisturizer products applied to the face using the hands (palms), primarily leave-on
0.60 %
Category 5C: Hand cream products applied to the hands using the hands (palms), primarily leave-on
0.60 %
Category 5D: Baby Creams, baby Oils and baby talc
0.20 %
Category 6: Products with oral and lip exposure
1.40 %
 Category 7: Products applied to the hair with some hand contact
Category 7A: Rinse-off products applied to the hair with some hand contact
3.00 %
Category 7B: Leave-on products applied to the hair with some hand contact
3.00 %
Category 8: Products with significant anogenital exposure
0.20 %
Category 9: Products with body and hand exposure, primarily rinse off
4.60 %
 Category 10: Household care products with mostly hand contact
Category 10A: Household care excluding aerosol products (excluding aerosol/spray products)
4.60 %
Category 10B: Household aerosol/spray products
17.00 %
 Category 11: Products with intended skin contact but minimal transfer of fragrance to skin from inert substrate
Category 11A: Products with intended skin contact but minimal transfer of fragrance to skin from inert substrate without UV exposure
0.20 %
Category 11B: Products with intended skin contact but minimal transfer of fragrance to skin from inert substrate with potential UV exposure
0.20 %
Category 12: Products not intended for direct skin contact, minimal or insignificant transfer to skin
No Restriction
 Notes:
IFRA FLAVOR REQUIREMENTS:

Due to the possible ingestion of small amounts of fragrance ingredients from their use in products in Categories 1 and 6, materials must not only comply with IFRA Standards but must also be recognized as safe as a flavoring ingredient as defined by the IOFI Code of Practice (www.iofi.org). For more details see chapter 1 of the Guidance for the use of IFRA Standards.

 
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: 24
Click here to view publication 24
 average usual ppmaverage maximum ppm
baked goods: 4.0000020.00000
beverages(nonalcoholic): 10.0000030.00000
beverages(alcoholic): 10.0000030.00000
breakfast cereal: 10.0000030.00000
cheese: --
chewing gum: 50.00000500.00000
condiments / relishes: --
confectionery froastings: 20.00000100.00000
egg products: --
fats / oils: 10.0000050.00000
fish products: --
frozen dairy: 8.0000050.00000
fruit ices: 8.0000050.00000
gelatins / puddings: 8.0000050.00000
granulated sugar: --
gravies: --
hard candy: 20.00000100.00000
imitation dairy: 10.0000030.00000
instant coffee / tea: 10.0000050.00000
jams / jellies: --
meat products: --
milk products: 10.0000030.00000
nut products: --
other grains: --
poultry: --
processed fruits: 10.0000030.00000
processed vegetables: --
reconstituted vegetables: --
seasonings / flavors: 20.00000100.00000
snack foods: --
soft candy: 20.00000100.00000
soups: 8.0000050.00000
sugar substitutes: --
sweet sauces: --
 
Safety References:
EPI System: View
Daily Med:search
Chemical Carcinogenesis Research Information System:Search
AIDS Citations:Search
Cancer Citations:Search
Toxicology Citations:Search
EPA Substance Registry Services (TSCA):23089-26-1
EPA ACToR:Toxicology Data
EPA Substance Registry Services (SRS):Registry
Laboratory Chemical Safety Summary :442343
National Institute of Allergy and Infectious Diseases:Data
WGK Germany:3
(2S)-6-methyl-2-[(1S)-4-methylcyclohex-3-en-1-yl]hept-5-en-2-ol
Chemidplus:0023089261
 
References:
 (2S)-6-methyl-2-[(1S)-4-methylcyclohex-3-en-1-yl]hept-5-en-2-ol
NIST Chemistry WebBook:Search Inchi
Canada Domestic Sub. List:23089-26-1
Pubchem (cid):442343
Pubchem (sid):135019623
Flavornet:23089-26-1
 
Other Information:
(IUPAC):Atomic Weights of the Elements 2011 (pdf)
Videos:The Periodic Table of Videos
tgsc:Atomic Weights use for this web site
(IUPAC):Periodic Table of the Elements
CHEBI:View
CHEMBL:View
KEGG (GenomeNet):C09621
HMDB (The Human Metabolome Database):HMDB36197
FooDB:FDB015053
VCF-Online:VCF Volatile Compounds in Food
ChemSpider:View
Wikipedia:View
FAO:alpha-Bisabolol
 
Potential Blenders and core components note
For Odor
coconut
alpha-
angelica lactone
FL/FR
gamma-
heptalactone
FL/FR
fatty
coconut absolute
FL/FR
fruity
allyl 2-ethyl butyrate
FL/FR
benzaldehyde
FL/FR
guaiacyl propionate
FL/FR
For Flavor
No flavor group found for these
cocos nucifera water
FL
guaiacyl propionate
FL/FR
methyl 2-(methyl thio) acetate
FL
burnt
burnt
2-
methyl quinoxaline
FL
creamy
alpha-
angelica lactone
FL/FR
ethereal
allyl 2-ethyl butyrate
FL/FR
fatty
coconut absolute
FL/FR
fruity
benzaldehyde
FL/FR
lactonic
gamma-
heptalactone
FL/FR
 
Potential Uses:
 skin conditioning
 soothing agents
 
Occurrence (nature, food, other):note
 chamomile german chamomile
Search Trop Picture
 chamomile sweet false chamomile flower
Search Trop Picture
 
Synonyms:
 bisabalol alpha natural
 bisabolife
(-)-(1'S,2S)-a-bisabolol
(-)-(4S,8S)-a-bisabolol
(-)-a-bisabolol
a-(-)-bisabolol
L-a-bisabolol
L-alpha-bisabolol
laevo-alpha-bisabolol
a-bisabolol (-)-form
alpha-bisabolol (-)-form
 bisabolol alpha natural
L-alpha-bisabolol natural
3-cyclohexene-1-methanol, a,4-dimethyl-a-(4-methyl-3-penten-1-yl)-, (aS,1S)-
(aS,1S)-a,4-dimethyl-a-(4-methyl-3-pentenyl)-3-cyclohexene-1-methanol
(S-(theta,theta))-alpha,4-dimethyl-alpha-(4-methyl-3-pentenyl)-3-cyclohexene-1-methanol
 levomenol
(-)-6-methyl-2-(4-methyl-3-cyclohexen-1-yl)-5-hepten-2-ol
(2S)-6-methyl-2-[(1S)-4-methyl-3-cyclohexen-1-yl]-5-hepten-2-ol
(2S)-6-methyl-2-[(1S)-4-methylcyclohex-3-en-1-yl]hept-5-en-2-ol
 
 
Notes:
Isol. from essential oil of Matricaria chamomilla (German chamomile)
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