EU/US Properties Organoleptics Cosmetics Suppliers Safety Safety in use Safety references References Other Blenders Uses Occurrence Synonyms Articles Notes
 

4-methyl pentyl 4-methyl valerate
4-methylpentyl 4-methylvalerate

Sponsors

Name:4-methylpentyl 4-methylpentanoate
CAS Number: 35852-42-7Picture of molecule3D/inchi
Nikkaji Web:J504.902D
XlogP3-AA:3.80 (est)
Molecular Weight:200.32168000
Formula:C12 H24 O2
NMR Predictor:Predict (works with chrome or firefox)
Category:flavoring 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
Google Patents:Search
US Patents:Search
EU Patents:Search
Pubchem Patents:Search
FEMA Number:4749 4-methylpentyl 4-methylvalerate
FDA:No longer provide for the use of these seven synthetic flavoring substances
 
Physical Properties:
Appearance:colorless to pale yellow clear liquid (est)
Assay: 95.00 to 100.00
Food Chemicals Codex Listed: No
Boiling Point: 222.02 °C. @ 760.00 mm Hg (est)
Vapor Pressure:0.104000 mm/Hg @ 25.00 °C. (est)
Flash Point: 197.00 °F. TCC ( 91.80 °C. ) (est)
logP (o/w): 4.591 (est)
Soluble in:
 alcohol
 water, 4.696 mg/L @ 25 °C (est)
Insoluble in:
 water
 
Organoleptic Properties:
Odor Type: fruity
Odor Strength:medium ,
recommend smelling in a 10.00 % solution or less
fruity waxy soapy herbal
Odor Description:at 10.00 % in dipropylene glycol. fruity waxy soapy herbal
Odor and/or flavor descriptions from others (if found).
 
Cosmetic Information:
None found
 
Suppliers:
Sigma-Aldrich
4-Methylpentyl 4-methylvalerate, ≥95%
Certified Food Grade Products
Chemical Sources Association
Need This Item for Flavor/Food?: You can contact the Chemical Sources Association
 
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:
Not determined
Dermal Toxicity:
Not determined
Inhalation Toxicity:
Not determined
 
Safety in Use Information:
Category: flavoring agents
Recommendation for 4-methyl pentyl 4-methyl valerate usage levels up to:
 not for fragrance use.
 
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: 26
 average usual ppmaverage maximum ppm
baked goods: 4.0000030.00000
beverages(nonalcoholic): 4.0000030.00000
beverages(alcoholic): 4.0000030.00000
breakfast cereal: 4.0000030.00000
cheese: 4.0000030.00000
chewing gum: 10.0000080.00000
condiments / relishes: 4.0000030.00000
confectionery froastings: 4.0000030.00000
egg products: --
fats / oils: --
fish products: --
frozen dairy: 4.0000030.00000
fruit ices: 4.0000030.00000
gelatins / puddings: 4.0000030.00000
granulated sugar: 4.0000030.00000
gravies: --
hard candy: 4.0000030.00000
imitation dairy: --
instant coffee / tea: 4.0000030.00000
jams / jellies: 4.0000030.00000
meat products: --
milk products: --
nut products: 4.0000030.00000
other grains: --
poultry: --
processed fruits: 4.0000030.00000
processed vegetables: --
reconstituted vegetables: --
seasonings / flavors: 4.0000030.00000
snack foods: 4.0000030.00000
soft candy: 4.0000030.00000
soups: --
sugar substitutes: --
sweet sauces: 4.0000030.00000
 
Safety References:
EPI System: View
EPA ACToR:Toxicology Data
EPA Substance Registry Services (SRS):Registry
Laboratory Chemical Safety Summary :88168807
National Institute of Allergy and Infectious Diseases:Data
WGK Germany:3
4-methylpentyl 4-methylpentanoate
 
References:
 4-methylpentyl 4-methylpentanoate
NIST Chemistry WebBook:Search Inchi
Pubchem (cid):88168807
Pubchem (cas):35852-42-7
 
Other Information:
(IUPAC):Atomic Weights of the Elements 2009
(IUPAC):Atomic Weights of the Elements 2009 (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
dodecanal (aldehyde C-12 lauric)
FL/FR
undecanal
FL/FR
citrus
10-
undecen-1-ol
FL/FR
fatty
allyl octanoate
FL/FR
iso
butyl undecylenate
FL/FR
methyl 10-undecenoate
FL/FR
floral
citronellyl propionate
FL/FR
dimethyl octanol
FL/FR
gelsone (IFF)
FL/FR
(E)-
geranyl acetone
FL/FR
geranyl hexanoate
FL/FR
jasmin absolute egypt (from concrete)
FL/FR
methyl citronellate
FL/FR
octyl acetate
FL/FR
fruity
allyl 10-undecenoate
FL/FR
allyl heptanoate
FL/FR
iso
amyl isobutyrate
FL/FR
iso
amyl octanoate
FL/FR
decyl butyrate
FL/FR
dimethyl succinate
FL/FR
ethyl (E)-2-decenoate
FL/FR
ethyl hexanoate
FL/FR
3-
hexanone
FL/FR
methyl (E,Z)-2,4-decadienoate
FL/FR
2-
nonanone
FL/FR
(E)-2-
nonen-1-yl acetate
FL/FR
octyl butyrate
FL/FR
2-
undecanone
FL/FR
green
ethyl (E)-4-decenoate
FL/FR
(Z)-3-
hexen-1-yl propionate
FL/FR
hexyl 2-methyl butyrate
FL/FR
hexyl butyrate
FL/FR
hexyl phenyl acetate
FL/FR
herbal
butyl levulinate
FL/FR
cardamom oleoresin
FL/FR
musk
iso
ambrettolide
FL/FR
soapy
benzyl laurate
FL/FR
ethyl undecanoate
FL/FR
vegetable
1-
furfuryl pyrrole
FL/FR
waxy
allyl nonanoate
FL/FR
butyl laurate
FL/FR
3-
decanone
FL/FR
dihydrocitronellyl acetate
FL/FR
1-
dodecanol
FL/FR
ethyl decanoate
FL/FR
ethyl palmitate
FL/FR
heptyl octanoate
FL/FR
methyl butyl phenyl acetate
FL/FR
methyl laurate
FL/FR
(E)-2-
octen-1-yl butyrate
FL/FR
octyl 2-methyl butyrate
FL/FR
octyl isobutyrate
FL/FR
propyl decanoate
FL/FR
(E)-2-
tridecen-1-yl acetate
FL/FR
For Flavor
No flavor group found for these
allyl 10-undecenoate
FL/FR
iso
butyl undecylenate
FL/FR
3-
decanone
FL/FR
dihydrocitronellyl acetate
FL/FR
methyl (E,Z)-2,4-decadienoate
FL/FR
(E)-2-
octen-1-yl butyrate
FL/FR
propyl decanoate
FL/FR
(E)-2-
tridecen-1-yl acetate
FL/FR
10-
undecen-1-ol
FL/FR
cheesy
cheesy
2-
nonanone
FL/FR
coconut
(R)-
massoia lactone
FL
creamy
octyl isobutyrate
FL/FR
ethereal
benzyl laurate
FL/FR
fatty
allyl octanoate
FL/FR
dimethyl octanol
FL/FR
ethyl (E)-4-decenoate
FL/FR
floral
citronellyl propionate
FL/FR
(E)-
geranyl acetone
FL/FR
jasmin absolute egypt (from concrete)
FL/FR
methyl citronellate
FL/FR
fruity
allyl heptanoate
FL/FR
iso
amyl isobutyrate
FL/FR
iso
amyl octanoate
FL/FR
decyl butyrate
FL/FR
dimethyl succinate
FL/FR
ethyl (E)-2-decenoate
FL/FR
ethyl hexanoate
FL/FR
geranyl hexanoate
FL/FR
3-
hexanone
FL/FR
hexyl phenyl acetate
FL/FR
green
gelsone (IFF)
FL/FR
(Z)-3-
hexen-1-yl propionate
FL/FR
(E)-3-
hexenoic acid
FL
hexyl 2-methyl butyrate
FL/FR
hexyl butyrate
FL/FR
methyl 2-undecynoate
FL
herbal
butyl levulinate
FL/FR
cardamom oleoresin
FL/FR
leafy
methyl butyl phenyl acetate
FL/FR
musk
iso
ambrettolide
FL/FR
soapy
dodecanal (aldehyde C-12 lauric)
FL/FR
1-
dodecanol
FL/FR
vegetable
1-
furfuryl pyrrole
FL/FR
waxy
allyl nonanoate
FL/FR
butyl laurate
FL/FR
ethyl decanoate
FL/FR
ethyl palmitate
FL/FR
ethyl undecanoate
FL/FR
heptyl octanoate
FL/FR
methyl 10-undecenoate
FL/FR
methyl laurate
FL/FR
(E)-2-
nonen-1-yl acetate
FL/FR
octyl 2-methyl butyrate
FL/FR
octyl acetate
FL/FR
octyl butyrate
FL/FR
undecanal
FL/FR
2-
undecanone
FL/FR
 
Potential Uses:
None Found
 
Occurrence (nature, food, other):note
 capsicum pubescens
Search Trop Picture
 chili amarillo chili
Search Trop Picture
 
Synonyms:
4-methyl pentyl 4-methyl pentanoate
4-methylpentanoic acid, 4-methylpentyl ester
4-methylpentyl 4-methylpentanoate
4-methylpentyl 4-methylvalerate
 pentanoic acid, 4-methyl-, 4-methylpentyl ester
 

Articles:

 None found yet.
 
Notes:
None found
Please share your Comments.
Email Address:
Top of Page Home
Copyright © 1980-2018 The Good Scents Company (tgsc) ™ Disclaimer Privacy Policy