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

deoxylapachol
2-(3-methyl-2-buten-1-yl)-1,4-naphthoquinone

Supplier Sponsors

Name:2-(3-methylbut-2-enyl)naphthalene-1,4-dione
CAS Number: 3568-90-9Picture of molecule3D/inchi
FDA UNII: M5RT9GV702
Nikkaji Web:J156.701B
XlogP3:3.80 (est)
Molecular Weight:226.27498000
Formula:C15 H14 O2
BioActivity Summary:listing
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
Google Books:Search
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Google Scholar: with word "odor"Search
Google Patents:Search
US Patents:Search
EU Patents:Search
Pubchem Patents:Search
PubMed:Search
NCBI:Search
 
Physical Properties:
Assay: 95.00 to 100.00
Food Chemicals Codex Listed: No
Boiling Point: 359.20 °C. @ 760.00 mm Hg (est)
Flash Point: 275.00 °F. TCC ( 134.80 °C. ) (est)
logP (o/w): 4.240 (est)
Soluble in:
 water, 11.9 mg/L @ 25 °C (est)
 
Organoleptic Properties:
Odor and/or flavor descriptions from others (if found).
 
Cosmetic Information:
None found
 
Suppliers:
Alfa Biotechnology
For experimental / research use only.
deoxylapachol 98%
BOC Sciences
For experimental / research use only.
Deoxylapachol
Coompo
For experimental / research use only.
Deoxylapachol from Plants ≥96%
 
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 deoxylapachol usage levels up to:
 not for fragrance use.
 
Recommendation for deoxylapachol flavor usage levels up to:
 not for flavor use.
 
Safety References:
EPI System: View
AIDS Citations:Search
Cancer Citations:Search
Toxicology Citations:Search
EPA ACToR:Toxicology Data
EPA Substance Registry Services (SRS):Registry
Laboratory Chemical Safety Summary :97448
National Institute of Allergy and Infectious Diseases:Data
2-(3-methylbut-2-enyl)naphthalene-1,4-dione
Chemidplus:0003568909
 
References:
 2-(3-methylbut-2-enyl)naphthalene-1,4-dione
NIST Chemistry WebBook:Search Inchi
Pubchem (cid):97448
Pubchem (sid):135053942
 
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):C10325
HMDB (The Human Metabolome Database):Search
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
 tectona grandis wood
Search Trop Picture
 
Synonyms:
2-demethylmenaquinone
2-(3-methyl-2-buten-1-yl)-1,4-naphthoquinone
2-(3-methyl-2-butenyl)-1,4-naphthalene dione
2-(3-methylbut-2-en-1-yl)naphthalene-1,4-dione
2-(3-methylbut-2-enyl)naphthalene-1,4-dione
1,4-naphthalenedione, 2-(3-methyl-2-buten-1-yl)-
1,4-naphthalenedione, 2-(3-methyl-2-butenyl)-
 oscillatoxin D
 
 
Notes:
major sensitizer of teak wood.
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