para-cresyl propionaldehyde, 5406-12-2

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Fragrance Demo Formulas
Name:	3-(4-methylphenyl)propanal
CAS Number:	5406-12-2	3D/inchi
ECHA EINECS - REACH Pre-Reg:	226-460-4
FDA UNII:	1RMD883W6C
Nikkaji Web:	J217.968G
MDL:	MFCD04112993
XlogP3-AA:	2.00 (est)
Molecular Weight:	148.20484000
Formula:	C10 H12 O
BioActivity Summary:	listing
NMR Predictor:	Predict (works with chrome, Edge or firefox)

Category:information only not used for fragrances or flavors

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:

Appearance:	colorless to pale yellow clear liquid (est)
Assay:	96.00 to 100.00
Food Chemicals Codex Listed:	No
Boiling Point:	222.00 to 223.00 °C. @ 760.00 mm Hg
Boiling Point:	120.00 °C. @ 21.00 mm Hg
Vapor Pressure:	0.088000 mmHg @ 25.00 °C. (est)
Flash Point:	> 212.00 °F. TCC ( > 100.00 °C. )
logP (o/w):	2.580
Soluble in:
	alcohol
	water, 483.4 mg/L @ 25 °C (est)
Insoluble in:
	water

Organoleptic Properties:

Odor Type: floral

heliotrope lily lilac

Odor Description:at 1.00 % in dipropylene glycol. heliotrope lily lilac

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

Cosmetic Information:

CosIng:	cosmetic data
Cosmetic Uses:	perfuming agents

Suppliers:

Matrix Scientific

For experimental / research use only.

3-(4-Methylphenyl)propionaldehyde, 97%

sds

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:
information only not used for fragrances or flavors
IFRA Critical Effect:
Dermal sensitization
	View the IFRA Standard
limits in the finished product for - "leave on the skin contact":
	0.2000 % Restriction.
limits in the finished product for - "wash off the skin contact":
	0.2000 % Restriction.
limits in the finished product for - "no skin contact":
	2.0000 % Restriction.
Recommendation for para-cresyl propionaldehyde usage levels up to:
	PROHIBITED: Should not be used as a fragrance ingredient.

Recommendation for para-cresyl propionaldehyde flavor usage levels up to:
	not for flavor use.

Safety References:

EPI System: View

AIDS Citations:Search

Cancer Citations:Search

Toxicology Citations:Search

EPA Substance Registry Services (TSCA):5406-12-2

EPA ACToR:Toxicology Data

EPA Substance Registry Services (SRS):Registry

Laboratory Chemical Safety Summary :64812

National Institute of Allergy and Infectious Diseases:Data

SCCNFP:opinion

WGK Germany:2

3-(4-methylphenyl)propanal

Chemidplus:0005406122

References:

	3-(4-methylphenyl)propanal
NIST Chemistry WebBook:	Search Inchi
Canada Domestic Sub. List:	5406-12-2
Pubchem (cid):	64812
Pubchem (sid):	135021549

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
VCF-Online:	VCF Volatile Compounds in Food
ChemSpider:	View

Potential Blenders and core components note

For Odor

aldehydic

citronellyl oxyacetaldehyde
FL/FR

lily pentanal
FR

nonanal (aldehyde C-9)
FL/FR

animal

para-

cresyl isobutyrate
FL/FR

para-

cresyl phenyl acetate
FL/FR

balsamic

linalyl cinnamate
FL/FR

phenyl propyl alcohol
FL/FR

citrus

benzyl anthranilate
FR

citrus ocimenol
FR

tetrahydromyrcenol
FR

floral

alpha-

amyl cinnamaldehyde dimethyl acetal
FL/FR

para-

anisaldehyde dimethyl acetal
FR

alpha-

butyl cinnamaldehyde
FL/FR

citronellyl ethoxalate
FR

cyclamen aldehyde / methyl anthranilate schiff's base
FR

cyclohexyl ethyl alcohol
FL/FR

(E,E)-

farnesol
FL/FR

heliotrope absolute
FR

heliotropin
FL/FR

heliotropyl acetone
FL/FR

hydroxycitronellal
FL/FR

hydroxycitronellal / methyl anthranilate schiff's base
FR

hydroxycitronellal diethyl acetal
FL/FR

hydroxycitronellal dimethyl acetal
FL/FR

hydroxycitronellal nitrile
FR

hydroxycitronellal replacer
FR

hydroxycitronellol
FL/FR

leerall / methyl anthranilate schiff's base
FR

(±)-

lilac aldehyde
FL/FR

lilac pentanol
FL/FR

lily propanol
FR

lilyall / methyl anthranilate schiff's base
FR

linalyl benzoate
FL/FR

linalyl propionate
FL/FR

magnolia decadienal
FR

methoxycitronellal
FR

para-

methyl acetophenone
FL/FR

methyl octanal
FL/FR

muguet carbaldehyde
FR

muguet carbinol
FL/FR

muguet nitrile
FR

muguet octadienol
FR

muguet propanol
FR

muguet shiseol
FL/FR

bitter

orangeflower absolute morocco
FL/FR

phenyl propyl acetate
FL/FR

phenyl-2-butanol
FL/FR

propiophenone
FL/FR

(+)-alpha-

terpineol
FL/FR

alpha-

terpinyl anthranilate
FL/FR

tetrahydrolinalool
FL/FR

ylang ylang flower oil
FL/FR

ylang ylang flower oil CO2 extract
FL/FR

ylang ylang flower oil I
FL/FR

ylang ylang flower oil II
FL/FR

ylang ylang flower oil III
FL/FR

fruity

bread thiophene
FL/FR

(Z)-3-

hexen-1-yl anthranilate
FL/FR

prenyl acetate
FL/FR

green

leafy acetal
FL/FR

lilac acetaldehyde
FL/FR

perilla alcohol
FL/FR

phenyl propionaldehyde
FL/FR

violet decenol
FR

herbal

diisobutyl carbinyl acetate
FR

dimethyl benzyl carbinyl formate
FL/FR

marine

ozone propanal
FR

powdery

para-

anisyl alcohol
FL/FR

spicy

para-

anisyl formate
FL/FR

terpenic

(-)-alpha-

terpineol
FL/FR

alpha-

terpineol
FL/FR

vanilla

vanillyl acetate
FL/FR

For Flavor

No flavor group found for these

alpha-

amyl cinnamaldehyde dimethyl acetal
FL/FR

dimethyl benzyl carbinyl formate
FL/FR

(E,E)-

farnesol
FL/FR

(±)-

lilac aldehyde
FL/FR

methyl octanal
FL/FR

phenyl propyl acetate
FL/FR

(+)-alpha-

terpineol
FL/FR

(-)-alpha-

terpineol
FL/FR

alpha-

terpinyl anthranilate
FL/FR

alpha-

butyl cinnamaldehyde
FL/FR

aldehydic

nonanal (aldehyde C-9)
FL/FR

aromatic

para-

cresyl isobutyrate
FL/FR

leafy acetal
FL/FR

berry

heliotropyl acetone
FL/FR

cherry

heliotropin
FL/FR

citrus

citronellyl oxyacetaldehyde
FL/FR

alpha-

terpineol
FL/FR

creamy

para-

methyl acetophenone
FL/FR

floral

(Z)-3-

hexen-1-yl anthranilate
FL/FR

muguet carbinol
FL/FR

muguet shiseol
FL/FR

bitter

orangeflower absolute morocco
FL/FR

phenyl-2-butanol
FL/FR

tetrahydrolinalool
FL/FR

ylang ylang flower oil
FL/FR

ylang ylang flower oil CO2 extract
FL/FR

ylang ylang flower oil I
FL/FR

ylang ylang flower oil II
FL/FR

ylang ylang flower oil III
FL/FR

fruity

para-

anisyl alcohol
FL/FR

bread thiophene
FL/FR

lilac acetaldehyde
FL/FR

lilac pentanol
FL/FR

linalyl benzoate
FL/FR

linalyl cinnamate
FL/FR

prenyl acetate
FL/FR

propiophenone
FL/FR

green

cyclohexyl ethyl alcohol
FL/FR

phenyl propionaldehyde
FL/FR

phenyl propyl alcohol
FL/FR

herbal

linalyl propionate
FL/FR

melon

hydroxycitronellal diethyl acetal
FL/FR

phenolic

para-

cresyl phenyl acetate
FL/FR

powdery

hydroxycitronellol
FL/FR

powdery ketone
FL

spicy

para-

anisyl formate
FL/FR

vanilla

vanillyl acetate
FL/FR

waxy

hydroxycitronellal
FL/FR

hydroxycitronellal dimethyl acetal
FL/FR

woody

perilla alcohol
FL/FR

Potential Uses:

FR	cinnamon
FR	heliotrope
FR	lilac
FR	lily

Occurrence (nature, food, other):note

cinnamon bark oil
Search Trop Picture

Synonyms:

	benzenepropanal, 4-methyl-
3-p-	cresyl propanal
3-para-	cresyl propanal
p-	cresyl propionaldehyde
para-	cresyl propionaldehyde
3-p-	cresyl propionaldeyde
3-para-	cresyl propionaldeyde
	hydrocinnamaldehyde, p-methyl-
4-	methyl benzene propanal
4-	methyl hydrocinnamaldehyde
p-	methyl hydrocinnamaldehyde
para-	methyl hydrocinnamaldehyde
para-	methyl hydrocinnamic aldehyde
3-(4-	methyl phenyl) propanal
3-(p-	methyl phenyl) propanal
3-(para-	methyl phenyl) propanal
3-(4-	methyl-phenyl)-propionaldehyde
4-	methylbenzenepropanal
p-	methylhydrocinnamic aldehyde
3-(4-	methylphenyl)propanal
3-(p-	methylphenyl)propanal
3-(4-	methylphenyl)propionaldehyde
3-p-	tolyl propionaldehyde
3-para-	tolyl propionaldehyde
3-p-	tolyl-propionaldehyde
3-p-	tolylpropionaldehyde

Articles:

US Patents:8,188,023 - 4-alkyl cyclohexanepropanal compounds and their use in perfume compositions

US Patents:4-alkyl 1-(3-methoxy-2-propen-1-yl) benzene compounds and their use in perfume compositions

Notes:

None found

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para-cresyl propionaldehyde 4-methylbenzenepropanal

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Articles:

para-cresyl propionaldehyde
4-methylbenzenepropanal