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acrolein dimethyl acetal
3,3-dimethoxyprop-1-ene

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CAS Number: 6044-68-4Picture of molecule3D/inchi
ECHA EINECS - REACH Pre-Reg:227-936-4
FDA UNII: Search
Nikkaji Web:J51.034C
Beilstein Number:1700037
MDL:MFCD00008632
XlogP3-AA:0.70 (est)
Molecular Weight:102.13310000
Formula:C5 H10 O2
BioActivity Summary:listing
NMR Predictor:Predict (works with chrome, Edge or firefox)
Category:information only not used for fragrances or flavors
 
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
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
Specific Gravity:0.88200 to 0.88600 @ 20.00 °C.
Pounds per Gallon - (est).: 7.348 to 7.381
Refractive Index:1.39400 to 1.39800 @ 20.00 °C.
Boiling Point: 88.00 °C. @ 760.00 mm Hg
Vapor Pressure:65.960999 mmHg @ 25.00 °C. (est)
Flash Point: 27.00 °F. TCC ( -2.78 °C. )
logP (o/w): 0.653 (est)
Soluble in:
 water, 3.703e+004 mg/L @ 25 °C (est)
Stability:
 alkalis
 
Organoleptic Properties:
Odor and/or flavor descriptions from others (if found).
 
Cosmetic Information:
None found
 
Suppliers:
Beijing Lys Chemicals
Acrolein Dimethyl Acetal
BOC Sciences
For experimental / research use only.
Acrolein dimethyl acetal
Sigma-Aldrich: Aldrich
For experimental / research use only.
Acrolein Dimethyl Acetal 98%
TCI AMERICA
For experimental / research use only.
Acrolein Dimethyl Acetal >97.0%(GC)
 
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:
intravenous-mouse LD50 56 mg/kg
U.S. Army Armament Research & Development Command, Chemical Systems Laboratory, NIOSH Exchange Chemicals. Vol. NX#03553

Dermal Toxicity:
Not determined
Inhalation Toxicity:
Not determined
 
Safety in Use Information:
Category:
information only not used for fragrances or flavors
Recommendation for acrolein dimethyl acetal usage levels up to:
 not for fragrance use.
 
Recommendation for acrolein dimethyl acetal 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 :80145
National Institute of Allergy and Infectious Diseases:Data
WGK Germany:3
3,3-dimethoxyprop-1-ene
Chemidplus:0006044684
RTECS:UC8500000 for cas# 6044-68-4
 
References:
 3,3-dimethoxyprop-1-ene
NIST Chemistry WebBook:Search Inchi
Pubchem (cid):80145
Pubchem (sid):135037410
 
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
Export Tariff Code:2911.00.5000
ChemSpider:View
Wikipedia:View
 
Potential Blenders and core components note
None Found
 
Potential Uses:
None Found
 
Occurrence (nature, food, other):note
 not found in nature
 
Synonyms:
 acroleindimethylacetal
3,3-dimethoxy-1-propene
3,3-dimethoxyprop-1-ene
3,3-dimethoxypropene
1-propene, 3,3-dimethoxy-
 
 
Notes:
None found
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