1,3-propanediol dicaprylate

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Product(s):
ZENOAT

CAS Number:	56519-71-2	3D/inchi
FDA UNII:	C577OMC6UH
Nikkaji Web:	J106.495I
XlogP3-AA:	6.40 (est)
Molecular Weight:	328.49272000
Formula:	C19 H36 O4
NMR Predictor:	Predict (works with chrome, Edge or firefox)
CAS Number:	93981-97-6	3D/inchi
ECHA EINECS - REACH Pre-Reg:	301-185-3
FDA UNII:	8D8I9Z0F1Z
Nikkaji Web:	J348.903E
Molecular Weight:	328.49272000
Formula:	C19 H36 O4
NMR Predictor:	Predict (works with chrome, Edge or firefox)

Category:emollients

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
Boiling Point:	410.30 °C. @ 760.00 mm Hg (est)
Flash Point:	378.00 °F. TCC ( 192.20 °C. ) (est)
logP (o/w):	6.674 (est)
Soluble in:
	water, 0.01328 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:

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:
emollients
Recommendation for 1,3-propanediol dicaprylate usage levels up to:
	not for fragrance use.

Recommendation for 1,3-propanediol dicaprylate 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 :3085110

National Institute of Allergy and Infectious Diseases:Data

3-octanoyloxypropyl octanoate

Chemidplus:0056519712

2-(2-ethylhexanoyloxy)propyl 2-ethylhexanoate

Chemidplus:0093981976

References:

	3-octanoyloxypropyl octanoate
NIST Chemistry WebBook:	Search Inchi
Pubchem (cid):	3085110
Pubchem (sid):	135233026
	2-(2-ethylhexanoyloxy)propyl 2-ethylhexanoate
NIST Chemistry WebBook:	Search Inchi
Pubchem (cid):	21960538
Pubchem (sid):	135202780

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

Potential Blenders and core components note

None Found

Potential Uses:

emollients

Occurrence (nature, food, other):note

not found in nature

Synonyms:

	captex 125
2-(2-	ethylhexanoyloxy)propyl 2-ethylhexanoate
1-	methyl ethylene 2-ethyl hexanoate
	octanoic acid, 1,3-propanediyl ester
3-	octanoyloxypropyl octanoate
	propylene glycol dioctanoate

Articles:

PubMed:Crystallization and phase behavior of fatty acid esters of 1,3 propanediol III: 1,3 propanediol dicaprylate/1,3 propanediol distearate (CC/SS) and 1,3 propanediol dicaprylate/1,3 propanediol dipalmitate (CC/PP) binary systems.

Notes:

None found

1,3-propanediol dicaprylate octanoic acid, 1,3-propanediyl ester

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Articles:

1,3-propanediol dicaprylate
octanoic acid, 1,3-propanediyl ester