We have found 46587 results matching your criteria.
Please wait while we search...
  1. 1.
    General Material Information
  2. 2.
    PhysChem Properties
  3. 3.
    Occurrences
  4. 4.
    Organoleptic Properties
  5. 5.
    Suppliers
  6. 6.
    Potential Uses
  7. 7.
    Regulatory & Documentation
  8. 8.
    Safety Information
  9. 9.
    Other Information
  10. 10.
    Blenders & Components
  11. 11.
    Literature & References

isobutyl valerate

Chemical Structure

General Material Information

Preferred name isobutyl valerate
Trivial Name Isobutyl valerate
Short Description pentanoic acid, 2-methylpropyl ester
Formula C9 H18 O2
CAS Number 10588-10-0
Flavis Number 9.25
ECHA Number 234-191-9
FDA UNII Search
Nikkaji Number J100.893E
COE Number 2303
xLogP3-AA 2.80 (est)
NMR Predictor External link
Synonyms
  • iso butyl N-valerate
  • iso butyl pentanoate
  • iso- butyl-valerate
  • 2-methylpropyl pentanoate
  • pentanoic acid 2-methyl propyl ester
  • pentanoic acid 2-methylpropyl ester
  • pentanoic acid, 2-methylpropyl ester
  • valeric acid, isobutyl ester
  • 2-methylpropyl pentanoate
  • Isobutyl valerinate
  • 2-Methylpropyl valerate
  • Isobutyl pentanoate
  • 2-Methyl-1-propyl pentanoate

US / EU / FDA / JECFA / FEMA / Scholar / Patents

Google Scholar Start search
Google Books Start search
Google Patents Start search
Perfumer & Flavorists Start search
EU Patents Start search
PubMeb Start search
NCBI Start search

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
Export Tariff Code:2915.60.0000
VCF-Online:VCF Volatile Compounds in Food
ChemSpider:View

PhysChem Properties

Material listed in food chemical codex No
Molecular weight 158.24085998535
Specific gravity @ 25 °C
Pounds per Gallon
Boiling Point 87 to 88°C @ 50 mm Hg
Vapor Pressure 1.09 mmHg @ 25 °C
Vapor Density 5.4
Flash Point TCC Value 55.56 °C TCC
logP (o/w) 3.177 est
Solubility
alcohol Yes
water, 117.8 mg/L @ 25 °C (est) Yes
water No

Organoleptic Properties

Odor Type: Fruity
ethereal, fruity
General comment At 10.00 % in dipropylene glycol. ethereal fruity
Flavor Type: Fruity
sweet, fruity, apple, strawberry
General comment Sweet fruity apple strawberry

Occurrences

Potential Uses

Applications
Odor purposes Apple, Banana, Fruit, Saffron, Wine
Other purposes Modifier

Safety Information

Safety information

European information :
Most important hazard(s):
Xi - Irritant
R 10 - Flammable.
R 36/38 - Irritating to skin and eyes.
S 02 - Keep out of the reach of children.
S 24/25 - Avoid contact with skin and eyes.
S 26 - In case of contact with eyes, rinse immediately with plenty of water and seek medical advice.
S 36 - Wear suitable protective clothing.
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
Recommendation for isobutyl valerate usage levels up to:
2.0000 % in the fragrance concentrate.

Safety references

EPI System: View
AIDS Citations:Search
Cancer Citations:Search
Toxicology Citations:Search
EPA Substance Registry Services (TSCA):10588-10-0
EPA ACToR:Toxicology Data
EPA Substance Registry Services (SRS):Registry
Laboratory Chemical Safety Summary :66356
National Institute of Allergy and Infectious Diseases:Data
WISER:UN 3272
WGK Germany:3
2-methylpropyl pentanoate
Chemidplus:0010588100