(Z)-4-propenyl phenol, 85960-81-2

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CODE158185 CODE158185
Product(s):

Name:	4-[(Z)-prop-1-enyl]phenol
CAS Number:	85960-81-2	3D/inchi
FDA UNII:	VQ6PDW0YG3
XlogP3:	2.60 (est)
Molecular Weight:	212.20164000
Formula:	C10 H12 O5
NMR Predictor:	Predict (works with chrome, Edge or firefox)

Category:flavor and fragrance agents

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
Perfumer and Flavorist:	Search
Google Patents:	Search
US Patents:	Search
EU Patents:	Search
Pubchem Patents:	Search
PubMed:	Search
NCBI:	Search
JECFA Food Flavoring:	2012 4-propenylphenol
FEMA Number:	4062 (Z)-4-propenylphenol
FDA:	No longer provide for the use of these seven synthetic flavoring substances
FDA Mainterm (SATF):	85960-81-2 ; (Z)-4-PROPENYLPHENOL

Physical Properties:

Appearance:	colorless to pale yellow clear liquid (est)
Assay:	95.00 to 100.00
Food Chemicals Codex Listed:	No
Specific Gravity:	0.97900 to 0.98800 @ 25.00 °C.
Pounds per Gallon - (est).:	8.146 to 8.221
Refractive Index:	1.55100 to 1.55600 @ 20.00 °C.
Boiling Point:	79.00 to 80.00 °C. @ 2.30 mm Hg
Boiling Point:	224.00 to 226.00 °C. @ 760.00 mm Hg
Vapor Pressure:	0.046000 mmHg @ 25.00 °C. (est)
Flash Point:	217.00 °F. TCC ( 102.90 °C. ) (est)
logP (o/w):	3.123 (est)
Soluble in:
	alcohol
	water, 1295 mg/L @ 25 °C (est)
Insoluble in:
	water

Organoleptic Properties:

Odor and/or flavor descriptions from others (if found).

Cosmetic Information:

None found

Suppliers:

Parchem

(Z)-4-propenyl phenol

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

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:
flavor and fragrance agents
RIFM Fragrance Material Safety Assessment: Search
IFRA Code of Practice Notification of the 49th Amendment to the IFRA Code of Practice

Structure Class:	I
Use levels for FEMA GRAS flavoring substances on which the FEMA Expert Panel based its judgments that the substances are generally recognized as safe (GRAS).
The Expert Panel also publishes separate extensive reviews of scientific information on all FEMA GRAS flavoring substances and can be found at FEMA Flavor Ingredient Library
publication number: 21
Click here to view publication 21
	average usual ppm	average maximum ppm
baked goods:	2.00000	5.00000
beverages(nonalcoholic):	1.00000	2.00000
beverages(alcoholic):	1.00000	2.00000
breakfast cereal:	-	-
cheese:	-	-
chewing gum:	4.00000	8.00000
condiments / relishes:	-	-
confectionery froastings:	-	-
egg products:	-	-
fats / oils:	-	-
fish products:	2.00000	4.00000
frozen dairy:	2.00000	4.00000
fruit ices:	-	-
gelatins / puddings:	-	-
granulated sugar:	-	-
gravies:	2.00000	4.00000
hard candy:	2.00000	4.00000
imitation dairy:	1.00000	2.00000
instant coffee / tea:	-	-
jams / jellies:	-	-
meat products:	2.00000	4.00000
milk products:	-	-
nut products:	1.00000	2.00000
other grains:	-	-
poultry:	-	-
processed fruits:	-	-
processed vegetables:	-	-
reconstituted vegetables:	-	-
seasonings / flavors:	2.00000	4.00000
snack foods:	2.00000	4.00000
soft candy:	2.00000	4.00000
soups:	2.00000	4.00000
sugar substitutes:	-	-
sweet sauces:	-	-

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 :415627

National Institute of Allergy and Infectious Diseases:Data

4-[(Z)-prop-1-enyl]phenol

Chemidplus:0085960812

References:

	4-[(Z)-prop-1-enyl]phenol
NIST Chemistry WebBook:	Search Inchi
Pubchem (cid):	415627
Pubchem (sid):	125696143

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 Substances Added to Food (formerly EAFUS):	View
HMDB (The Human Metabolome Database):	HMDB30839
FooDB:	FDB002795
ChemSpider:	View

Potential Blenders and core components note

None Found

Potential Uses:

None Found

Occurrence (nature, food, other):note

not found in nature

Synonyms:

iso	chavicol
4-[(1Z)-	prop-1-en-1-yl]phenol
4-[(Z)-	prop-1-enyl]phenol
(Z)-4-	propen-1-yl phenol
cis-4-	propen-1-yl phenol
4-[(1Z)-1-	propen-1-yl]phenol
cis-4-	propenyl phenol
(Z)-4-(1-	propenyl)phenol
(Z)-4-	propenylphenol
cis-4-	propenylphenol

Articles:

PubMed:Characterization of volatile compounds of Daucus crinitus Desf. Headspace Solid Phase Microextraction as alternative technique to Hydrodistillation.

PubMed:Bioactive phenylpropanoids from Daucus crinitus Desf. from Algeria.

PubMed:Impact of the arylhydrocarbon receptor on eugenol- and isoeugenol-induced cell cycle arrest in human immortalized keratinocytes (HaCaT).

PubMed:Eugenol causes melanoma growth suppression through inhibition of E2F1 transcriptional activity.

PubMed:Two new phenylpropanoid glycosides from the stem bark of Acanthopanax trifoliatus.

PubMed:[Studies on the chemical constituents of the root of Pimpinella thellungiana].

PubMed:Enantioselective hydroxylation of 4-alkylphenols by vanillyl alcohol oxidase

PubMed:Liquid chromatographic separation and fluorometric determination of cis- and trans-isoeugenol in perfumes, colognes, and toilet waters.

PubMed:In vivo metabolism of nasally instilled dihydrosafrole [1-(3,4-methylenedioxyphenyl)propane] in dogs and monkeys.

Notes:

Used as a food additive [EAFUS]

(Z)-4-propenyl phenol cis-4-propenylphenol

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Articles:

(Z)-4-propenyl phenol
cis-4-propenylphenol