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myrmac carboxaldehyde
aldemone

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Fragrance Demo Formulas
Name:1-methyl-4-(4-methylpent-3-enyl)cyclohex-3-ene-1-carbaldehyde
CAS Number: 52475-86-2Picture of molecule3D/inchi
ECHA EINECS - REACH Pre-Reg:257-942-2
FDA UNII: Search
Nikkaji Web:J24.272A
XlogP3-AA:3.30 (est)
Molecular Weight:206.32854000
Formula:C14 H22 O
NMR Predictor:Predict (works with chrome, Edge 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:colorless to pale yellow clear liquid (est)
Assay: 95.00 to 100.00
Food Chemicals Codex Listed: No
Boiling Point: 280.00 to 281.00 °C. @ 760.00 mm Hg (est)
Vapor Pressure:0.004000 mmHg @ 25.00 °C. (est)
Flash Point: 210.00 °F. TCC ( 98.70 °C. ) (est)
logP (o/w): 4.013 (est)
Soluble in:
 alcohol
 water, 1.512 mg/L @ 25 °C (est)
Insoluble in:
 water
 
Organoleptic Properties:
Odor Type: aldehydic
aldehydic clean herbal ozone
Odor Description:at 100.00 %. aldehydic clean herbal ozone
Odor and/or flavor descriptions from others (if found).
 
Cosmetic Information:
None found
 
Suppliers:
Indukern F&F
ALDEMONE
Odor: CLEAN, ALDEHYDIC, HERBAL, OZONIC
 
Safety Information:
 
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
RIFM Fragrance Material Safety Assessment: Search
IFRA Code of Practice Notification of the 49th Amendment to the IFRA Code of Practice
 
Recommendation for myrmac carboxaldehyde flavor usage levels up to:
 not for flavor use.
 
Safety References:
EPI System: View
AIDS Citations:Search
Cancer Citations:Search
Toxicology Citations:Search
EPA Substance Registry Services (TSCA):52475-86-2
EPA ACToR:Toxicology Data
EPA Substance Registry Services (SRS):Registry
Laboratory Chemical Safety Summary :95596
National Institute of Allergy and Infectious Diseases:Data
WGK Germany:2
1-methyl-4-(4-methylpent-3-enyl)cyclohex-3-ene-1-carbaldehyde
Chemidplus:0052475862
 
References:
 1-methyl-4-(4-methylpent-3-enyl)cyclohex-3-ene-1-carbaldehyde
NIST Chemistry WebBook:Search Inchi
Canada Domestic Sub. List:52475-86-2
Pubchem (cid):95596
Pubchem (sid):135052892
 
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
HMDB (The Human Metabolome Database):Search
ChemSpider:View
 
Potential Blenders and core components note
For Odor
aldehydic
N/i-
tridecanal
FR
tridecanal
FL/FR
undecenal mixture (aldehyde C-11 mixed)
FL/FR
balsamic
benzyl salicylate
FL/FR
verbenol
FL/FR
citrus
(S)-(-)-
citronellal
FL/FR
clean
sea
cotton fragrance
FR
floral
9-
decen-1-ol
FL/FR
fresh
decyl methyl ether
FR
green
3,5,6-neo
cyclocitral
FR
herbal
buchu oxime
FR
savin wood oil (juniperus phoenicea)
FL/FR
tropical
beta-
cyclocitral
FL/FR
waxy
(E)-
geranyl oxyacetaldehyde
FR
For Flavor
No flavor group found for these
(S)-(-)-
citronellal
FL/FR
savin wood oil (juniperus phoenicea)
FL/FR
undecenal mixture (aldehyde C-11 mixed)
FL/FR
balsamic
balsamic
benzyl salicylate
FL/FR
herbal
verbenol
FL/FR
tropical
beta-
cyclocitral
FL/FR
waxy
9-
decen-1-ol
FL/FR
tridecanal
FL/FR
 
Potential Uses:
None Found
 
Occurrence (nature, food, other):note
 not found in nature
 
Synonyms:
 aldemone
3-cyclohexene-1-carboxaldehyde, 1-methyl-4-(4-methyl-3-penten-1-yl)-
3-cyclohexene-1-carboxaldehyde, 1-methyl-4-(4-methyl-3-pentenyl)-
 methyl methyl pentenyl cyclohexene-1-carbaldehyde
4-(4-methyl-3-pentenyl)-1-methyl-3-cyclohexene-1-carboxaldehyde
1-methyl-4-(4-methyl pent-3-enyl) cyclohex-3-ene-1-carbaldehyde
1-methyl-4-(4-methyl-3-pentenyl) cyclohex-3-ene-1-carbaldehyde
1-methyl-4-(4-methyl-3-pentenyl)-3-cyclohexene-1-carboxaldehyde
1-methyl-4-(4-methyl-3-pentenyl)cyclohex-3-ene-1-carbaldehyde
1-methyl-4-(4-methyl-pent-3-enyl)-cyclohex-3-enecarbaldehyde
1-methyl-4-(4-methylpent-3-en-1-yl)cyclohex-3-ene-1-carbaldehyde
1-methyl-4-(4-methylpent-3-en-1-yl)cyclohex-3-enecarbaldehyde
1-methyl-4-(4-methylpent-3-enyl)cyclohex-3-ene-1-carbaldehyde
 
 
Notes:
None found
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