isopropyl PCA
proline, 5-oxo-, 1-methylethyl ester
 
Notes:
None found
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CAS Number: 85136-11-4Picture of molecule3D/inchi
Nikkaji Web: J1.711.804H
XlogP3-AA: 0.40 (est)
Molecular Weight: 171.19621000
Formula: C8 H13 N O3
NMR Predictor: Predict (works with chrome or firefox)
Category: humectants
 
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Physical Properties:
Assay: 95.00 to 100.00 % 
Food Chemicals Codex Listed: No
Soluble in:
 water, 2.025e+004 mg/L @ 25 °C (est)
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Organoleptic Properties:
 
Odor and/or flavor descriptions from others (if found).
 
 
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Cosmetic Information:
CosIng: cosmetic data
Cosmetic Uses: humectants
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Suppliers:
 None found
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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
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Safety in Use Information:
Category: humectants
Recommendation for isopropyl PCA usage levels up to:
 not for fragrance use.
 
Recommendation for isopropyl PCA flavor usage levels up to:
 not for flavor use.
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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 : 97590
National Institute of Allergy and Infectious Diseases: Data
 propan-2-yl 5-oxopyrrolidine-2-carboxylate
Chemidplus: 0085136114
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References:
 propan-2-yl 5-oxopyrrolidine-2-carboxylate
NIST Chemistry WebBook: Search Inchi
Pubchem (cid): 97590
Pubchem (sid): 135266072
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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
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Potential Blenders and core components note
 
None Found
 
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Potential Uses:
None Found
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Occurrence (nature, food, other): note
 not found in nature
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Synonyms:
 proline, 5-oxo-, 1-methylethyl ester
 propan-2-yl 5-oxopyrrolidine-2-carboxylate
isopropyl 5-oxo-DL-prolinate
isopropyl 5-oxoprolinate
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