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alitame hydrate
L-alpha-aspartyl-N-(2,2,4,4-tetramethyl-3-thietanyl)-D-alaninamide hydrate (2:5)

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Name:(3S)-3-amino-4-oxo-4-[[(2R)-2-[(2,2,4,4-tetramethylthietan-3-yl)amino]propanoyl]amino]butanoic acid pentahydrate
CAS Number: 99016-42-9Picture of molecule3D/inchi
Molecular Weight:752.94780000
Formula:C28 H60 N6 O13 S2
NMR Predictor:Predict (works with chrome, Edge or firefox)
Category:sweeteners, flavor enhancers
US / EU / FDA / JECFA / FEMA / FLAVIS / Scholar / Patent Information:
Google Scholar:Search
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Physical Properties:
Appearance:white crystalline powder (est)
Assay: 98.00 to 100.00
Food Chemicals Codex Listed: No
Boiling Point: 512.00 to 513.00 °C. @ 760.00 mm Hg (est)
Flash Point: 507.00 °F. TCC ( 263.90 °C. ) (est)
logP (o/w): 0.578 (est)
Organoleptic Properties:
Odor Type: odorless
Odor Strength:none
Odor Description:at 100.00 %. odorless
Flavor Type: sweet
sweet sugar candy
Taste Description: sweet sugar
Odor and/or flavor descriptions from others (if found).
Cosmetic Information:
None found
Chemical Sources Association
Need This Item for Flavor/Food?: You can contact the Chemical Sources Association
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
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:
sweeteners, flavor enhancers
Recommendation for alitame hydrate usage levels up to:
 not for fragrance use.
Recommendation for alitame hydrate flavor usage levels up to:
 not for flavor use.
Safety References:
AIDS Citations:Search
Cancer Citations:Search
Toxicology Citations:Search
EPA ACToR:Toxicology Data
EPA Substance Registry Services (SRS):Registry
Laboratory Chemical Safety Summary :5489902
National Institute of Allergy and Infectious Diseases:Data
(3S)-3-amino-4-oxo-4-[[(2R)-2-[(2,2,4,4-tetramethylthietan-3-yl)amino]propanoyl]amino]butanoic acid pentahydrate
 (3S)-3-amino-4-oxo-4-[[(2R)-2-[(2,2,4,4-tetramethylthietan-3-yl)amino]propanoyl]amino]butanoic acid pentahydrate
NIST Chemistry WebBook:Search Inchi
Pubchem (cid):5489902
Pubchem (sid):135121009
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
FDA Listing of Food Additive Status:View
Potential Blenders and core components note
None Found
Potential Uses:
Occurrence (nature, food, other):note
 not found in nature
D-alaninamide, L-apha-aspartyl-N-(2,2,4,4-tetramethyl-3-thietanyl)- hydrate (2:5)
(3S)-3-amino-4-oxo-4-[[(2R)-2-[(2,2,4,4-tetramethylthietan-3-yl)amino]propanoyl]amino]butanoic acid pentahydrate
(3S)-amino-N-((1R)-1-((2,2,4,4-tetramethyl-3-thietanyl)carbamoyl)ethyl)succinamic acid hydrate (2:5)
L-alpha-aspartyl-N-(2,2,4,4-tetramethyl-3-thietanyl)-D-alaninamide hydrate (2:5)
None found
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