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indole acetaldehyde
1H-indole-3-acetaldehyde

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CAS Number: 2591-98-2Picture of molecule3D/inchi
FDA UNII: Search
Nikkaji Web:J398.271H
Beilstein Number:121586
MDL:MFCD00056920
XlogP3:1.30 (est)
Molecular Weight:159.18793000
Formula:C10 H9 N O
NMR Predictor:Predict (works with chrome, Edge or firefox)
Category:natural substances and extractives
 
US / EU / FDA / JECFA / FEMA / FLAVIS / Scholar / Patent Information:
Google Scholar:Search
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Google Patents:Search
US Patents:Search
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PubMed:Search
NCBI:Search
 
Physical Properties:
Assay: 95.00 to 100.00
Food Chemicals Codex Listed: No
Soluble in:
 water, 2948 mg/L @ 25 °C (est)
 
Organoleptic Properties:
Odor and/or flavor descriptions from others (if found).
 
Cosmetic Information:
None found
 
Suppliers:
BOC Sciences
For experimental / research use only.
Indol-3-acetaldehyde 95%
 
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:
natural substances and extractives
Recommendation for indole acetaldehyde usage levels up to:
 not for fragrance use.
 
Recommendation for indole acetaldehyde flavor usage levels up to:
 not for flavor use.
 
Safety References:
EPI System: View
Chemical Carcinogenesis Research Information System:Search
AIDS Citations:Search
Cancer Citations:Search
Toxicology Citations:Search
EPA ACToR:Toxicology Data
EPA Substance Registry Services (SRS):Registry
Laboratory Chemical Safety Summary :800
National Institute of Allergy and Infectious Diseases:Data
2-(1H-indol-3-yl)acetaldehyde
Chemidplus:0002591982
 
References:
 2-(1H-indol-3-yl)acetaldehyde
NIST Chemistry WebBook:Search Inchi
Pubchem (cid):800
Pubchem (cas):2591-98-2
 
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
Golm Metabolome Database:Search
KEGG (GenomeNet):C00637
HMDB (The Human Metabolome Database):HMDB01190
FooDB:FDB013950
YMDB (Yeast Metabolome Database):YMDB00354
VCF-Online:VCF Volatile Compounds in Food
ChemSpider:View
Wikipedia:View
 
Potential Blenders and core components note
None Found
 
Potential Uses:
None Found
 
Occurrence (nature, food, other):note
 cucumber
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 pea
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 sunflower
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Synonyms:
2-(1H-indol-3-yl)acetaldehyde
1H-indole-3-acetaldehyde
 indoleacetaldehyde
 
 
Notes:
Indoleacetaldehyde is a substrate for Retina-specific copper amine oxidase, Aldehyde dehydrogenase X (mitochondrial), Amine oxidase B, Amiloride-sensitive amine oxidase, Aldehyde dehydrogenase (mitochondrial), Fatty aldehyde dehydrogenase, 4-trimethylaminobutyraldehyde dehydrogenase, Aldehyde dehydrogenase (dimeric NADP-preferring), Aldehyde dehydrogenase family 7 member A1, Amine oxidase A, Aldehyde dehydrogenase 1A3 and Membrane copper amine oxidase. [HMDB]
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