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pentaerythrityl tetrabenzoate
benzoic acid, tetraester with pentaerythritol

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Name:[3-benzoyloxy-2,2-bis(benzoyloxymethyl)propyl] benzoate
CAS Number: 4196-86-5Picture of molecule3D/inchi
Other(deleted CASRN):1579279-32-5
ECHA EINECS - REACH Pre-Reg:224-079-8
FDA UNII: U7L44GIS4O
Nikkaji Web:J53.723C
Beilstein Number:3513249
MDL:MFCD00020676
XlogP3-AA:6.50 (est)
Molecular Weight:552.57976000
Formula:C33 H28 O8
BioActivity Summary:listing
NMR Predictor:Predict (works with chrome, Edge or firefox)
Category:emollients
 
US / EU / FDA / JECFA / FEMA / FLAVIS / Scholar / Patent Information:
Google Scholar:Search
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Google Patents:Search
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NCBI:Search
FDA Mainterm (IAUFC):4196-86-5 ; PENTAERYTHRITOL TETRABENZOATE
 
Physical Properties:
Appearance:cream solid (est)
Assay: 95.00 to 100.00
Food Chemicals Codex Listed: No
Boiling Point: 684.31 °C. @ 760.00 mm Hg (est)
Flash Point: 547.00 °F. TCC ( 286.20 °C. ) (est)
logP (o/w): 8.140 (est)
Soluble in:
 water, 0.0006616 mg/L @ 25 °C (est)
 
Organoleptic Properties:
Odor and/or flavor descriptions from others (if found).
 
Cosmetic Information:
CosIng:cosmetic data
Cosmetic Uses: skin conditioning - emollient
 
Suppliers:
BOC Sciences
For experimental / research use only.
Pentaerythrityl Tetrabenzoate
Charkit Chemical
PENTAERYTHRITOL TETRABENZOATE
Santa Cruz Biotechnology
For experimental / research use only.
Pentaerythrityl Tetrabenzoate
Sigma-Aldrich: Aldrich
For experimental / research use only.
Pentaerythritol tetrabenzoate 96%
TCI AMERICA
For experimental / research use only.
Pentaerythrityl Tetrabenzoate >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:
oral-rat LD50 1158 mg/kg
Drugs in Japan Vol. -, Pg. 1105, 1990.

Dermal Toxicity:
Not determined
Inhalation Toxicity:
Not determined
 
Safety in Use Information:
Category:
emollients
Recommendation for pentaerythrityl tetrabenzoate usage levels up to:
 not for fragrance use.
 
Recommendation for pentaerythrityl tetrabenzoate 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 Substance Registry Services (TSCA):4196-86-5
EPA ACToR:Toxicology Data
EPA Substance Registry Services (SRS):Registry
Laboratory Chemical Safety Summary :20167
National Institute of Allergy and Infectious Diseases:Data
WGK Germany:3
[3-benzoyloxy-2,2-bis(benzoyloxymethyl)propyl] benzoate
Chemidplus:0004196865
EPA/NOAA CAMEO:hazardous materials
RTECS:RZ2605000 for cas# 4196-86-5
 
References:
 [3-benzoyloxy-2,2-bis(benzoyloxymethyl)propyl] benzoate
NIST Chemistry WebBook:Search Inchi
Canada Domestic Sub. List:4196-86-5
Pubchem (cid):20167
Pubchem (sid):134984925
 
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
FDA Indirect Additives used in Food Contact Substances:View
CHEMBL:View
HMDB (The Human Metabolome Database):Search
Export Tariff Code:2917.19.7050
ChemSpider:View
 
Potential Blenders and core components note
None Found
 
Potential Uses:
None Found
 
Occurrence (nature, food, other):note
 not found in nature
 
Synonyms:
 benzoflex S-552
 benzoic acid, tetraester with pentaerythritol
[3-benzoyloxy-2,2-bis(benzoyloxymethyl)propyl] benzoate
3-(benzoyloxy)-2,2-bis[(benzoyloxy)methyl]propyl benzoate
2,2-bis((benzoyloxy)methyl)-1,3-propanediol dibenzoate
2,2-bis((benzoyloxy)methyl)dibenzoate propanediol
2,2-bis[(benzoyloxy)methyl]dibenzoate propanediol
 pentaerythriol tetrabenzoate
 pentaerythritol tetrabenzoate
 pentaerythritoltetrabenzoate
3-[(phenylcarbonyl)oxy]-2,2-bis{[(phenylcarbonyl)oxy]methyl}propyl benzoate
2,2-bis(phenylcarbonyloxymethyl)-3-phenylcarbonyloxypropyl benzoate
 propanediol (2,2-bis (benzoyloxy)methyl)-dibenzoate
1,3-propanediol, 2,2-bis((benzoyloxy)methyl)-, dibenzoate
1,3-propanediol, 2,2-bis[ (benzoyloxy)methyl]-, dibenzoate
1,3-propanediol, 2,2-bis[(benzoyloxy)methyl]-, dibenzoate
 uniplex 552
 
 
Notes:
None found
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