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

docosane
docosane, N-

Sponsors

CAS Number: 629-97-0Picture of molecule3D/inchi
ECHA EINECS - REACH Pre-Reg:211-121-5
FDA UNII:OW99Q363KO
Nikkaji Web:J1.707H
Beilstein Number:1702206
MDL:MFCD00009348
XlogP3:11.50 (est)
Molecular Weight:310.60862000
Formula:C22 H46
BioActivity Summary:listing
NMR Predictor:Predict (works with chrome or firefox)
Category: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
 
Physical Properties:
Appearance:white solid (est)
Assay: 98.00 to 100.00
Food Chemicals Codex Listed: No
Specific Gravity:0.77800 25.00 °C.
Melting Point: 43.00 to 45.00 °C. @ 760.00 mm Hg
Boiling Point: 368.00 to 370.00 °C. @ 760.00 mm Hg
Vapor Pressure:0.000020 mm/Hg @ 25.00 °C. (est)
Vapor Density:10.8 ( Air = 1 )
Flash Point:> 230.00 °F. TCC ( > 110.00 °C. )
logP (o/w): 11.916 (est)
Soluble in:
 alcohol
 water, 9.367e-007 mg/L @ 25 °C (est)
Insoluble in:
 water
 
Organoleptic Properties:
Odor Strength:low
Odor Description:at 100.00 %. waxy
Odor and/or flavor descriptions from others (if found).
 
Cosmetic Information:
CosIng:cosmetic data
Cosmetic Uses: perfuming agents
 
Suppliers:
EMD Millipore
For experimental / research use only.
Docosane
Santa Cruz Biotechnology
For experimental / research use only.
Docosane
Sigma-Aldrich: Aldrich
For experimental / research use only.
Docosane 99%
TCI AMERICA
For experimental / research use only.
Docosane >98.0%(GC)
 
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:
Not determined
Dermal Toxicity:
Not determined
Inhalation Toxicity:
Not determined
 
Safety in Use Information:
Category: fragrance agents
Recommendation for docosane usage levels up to:
  8.0000 % in the fragrance concentrate.
 
Recommendation for docosane flavor usage levels up to:
 not for flavor use.
 
Safety References:
EPI System: View
EPA Substance Registry Services (TSCA):629-97-0
EPA ACToR:Toxicology Data
EPA Substance Registry Services (SRS):Registry
Laboratory Chemical Safety Summary :12405
National Institute of Allergy and Infectious Diseases:Data
WGK Germany:3
docosane
Chemidplus:0000629970
EPA/NOAA CAMEO:hazardous materials
 
References:
 docosane
NIST Chemistry WebBook:Search Inchi
Canada Domestic Sub. List:629-97-0
Pubchem (cid):12405
Pubchem (sid):134976593
Flavornet:629-97-0
Pherobase:View
 
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
CHEBI:View
CHEMBL:View
Golm Metabolome Database:Search
HMDB (The Human Metabolome Database):Search
FooDB:FDB004725
Export Tariff Code:2901.10.5000
Haz-Map:View
Typical G.C.
VCF-Online:VCF Volatile Compounds in Food
ChemSpider:View
Wikipedia:View
RSC Learn Chemistry:View
 
Potential Blenders and core components note
For Odor
No odor group found for these
eicosane
FR
henicosane
FR
pentadecane
FR
tricosane
FR
aldehydic
aldehydic
geranyl oxyacetaldehyde
FR
lily pentanal
FR
2-
methyl undecanal dimethyl acetal
FR
TMH aldehyde
FR
N-/i-
undecanal
FR
(Z)-8-
undecenal
FR
8-
undecenal
FR
citrus
citronellyl nitrile
FR
lime octadienal
FR
tangerine acetate
FR
waxy nitrile
FR
fatty
(Z)-2-
nonenal
CS
floral
alpha-
amyl cinnamaldehyde / methyl anthranilate schiff's base
FR
cassie concrete
FR
citronellyl ethoxalate
FR
decanal / methyl anthranilate schiff's base
FR
dewy propionate
FR
jasmin cyclopentanol
FR
muguet butanal
FR
muguet ethanol
FR
rose blossom pentanol
FR
(E)-2,5,9-
trimethyl-4,9-decadien-1-al
FR
vetiver pentanone
FR
fruity
(Z)-3-
hexen-1-yl 2-methyl-2-pentenoate
FR
green
green carbaldehyde
FR
2-
heptyl tetrahydrofuran
FR
phenyl acetaldehyde ethylene glycol acetal
FR
musk
ethylene dodecanoate
FR
(E)-12-
musk decenone
FR
musk decenone
FR
waxy
methyl undecanoate
FR
palmitic acid
FR
(E)-2-
undecen-1-yl acetate
FR
waxy acetate
FR
waxy undecadienol
FR
woody
cedrenyl acetate
FR
sandal cyclopentane
FR
For Flavor
No flavor group found for these
furfuryl hexanoate
FL
massoia bark oil
FL
coconut
coconut
(R)-
massoia lactone
FL
fatty
2,4-
octadien-1-ol
FL
(E)-2-
octenoic acid
FL
floral
pseudo
ionone
FL
fruity
(E)-2-
decenoic acid
FL
ethyl (E)-2-octenoate
FL
green
methyl 2-undecynoate
FL
herbal
5-
hydroxymethyl furfural
FL
spicy
4-
methyl biphenyl
FL
waxy
furfuryl octanoate
FL
octyl 2-furoate
FL
 
Potential Uses:
 waxy 
 
Occurrence (nature, food, other):note
 allspice plant
Search Trop Picture
 basswood flower
Search Trop Picture
 cabocla flower oil brazil @ 2.40%
Data GC Search Trop Picture
 cassie absolute @ 0.09%
Data GC Search Trop Picture
 coffee
Search PMC Picture
 couroupita guianensis aubl. flower oil brazil @ 0.10%
Data GC Search Trop Picture
 herniaria incana lam. oil greece @ 0.20%
Data GC Search Trop Picture
 jambu flower oil brazil @ 0.10%
Data GC Search Trop Picture
 kewda oil @ trace-0.16%
Data GC Search Trop Picture
 lemon balm tissue culture
Search Trop Picture
 narcissus absolute @ 0.04%
Data GC Search Trop Picture
 osmanthus absolute @ 0.03%
Data GC Search Trop Picture
 papaya seed oil
Search Trop Picture
 sunflower seed
Search Trop Picture
 witch hazel leaf oil @ 1.27%
Data GC Search Trop Picture
 
Synonyms:
N-docosane
 docosane, N-
 doeicosane
 
 
Notes:
None found
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