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Propyl hexanoate information


Propyl hexanoate
Names
Preferred IUPAC name
Propyl hexanoate
Other names
Propyl caproate
Identifiers
CAS Number
  • 626-77-7 checkY
3D model (JSmol)
  • Interactive image
ChemSpider
  • 11790
ECHA InfoCard 100.009.967 Edit this at Wikidata
EC Number
  • 210-963-0
PubChem CID
  • 12293
UNII
  • 30A840S94U checkY
CompTox Dashboard (EPA)
  • DTXSID3060823 Edit this at Wikidata
InChI
  • InChI=1S/C9H18O2/c1-3-5-6-7-9(10)11-8-4-2/h3-8H2,1-2H3
    Key: HTUIWRWYYVBCFT-UHFFFAOYSA-N
  • InChI=1/C9H18O2/c1-3-5-6-7-9(10)11-8-4-2/h3-8H2,1-2H3
    Key: HTUIWRWYYVBCFT-UHFFFAOYAY
SMILES
  • CCCCCC(=O)OCCC
Properties
Chemical formula
 C9H18O2
Molar mass 158.241 g·mol−1
Appearance Clear, colorless liquid
Melting point −68 °C (−90 °F; 205 K)
Boiling point 186 °C (367 °F; 459 K)
Except where otherwise noted, data are given for materials in their standard state (at 25 °C [77 °F], 100 kPa).
Infobox references

Propyl hexanoate (C9H18O2), also known as propyl caproate, is an ester formed by the reaction of propanol with hexanoic acid. Although it is a completely different ester, propyl hexanoate shares the same chemical formula with methyl octanoate, ethyl heptanoate, butyl pentanoate, etc. because they all have the same total carbon chain length. The scent of this ester can be described as that of blackberries, pineapple, cheese or wine.[1]

  1. ^ The Good Scents Company

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Propyl hexanoate

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Propyl hexanoate (C9H18O2), also known as propyl caproate, is an ester formed by the reaction of propanol with hexanoic acid. Although it is a completely...

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Methyl hexanoate

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cause burns. Methyl hexanoate is flammable. It has a flash point of 163 °F (73 °C). Ethyl hexanoate Propyl hexanoate "Methyl hexanoate". PubChem. Retrieved...

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List of esters

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thegoodscentscompany.com Ethyl isovalerate, thegoodscentscompany.com Ethyl hexanoate, thegoodscentscompany.com Ethyl heptanoate, thegoodscentscompany.com Ethyl...

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Strawberry

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ocimenol octyl acetate octyl butyrate octyl hexanoate octyl isovalerate propyl butyrate propyl hexanoate As strawberry flavor and fragrance are characteristics...

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Ester

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pineapple Pentyl hexanoate (amyl caproate) apple, pineapple Pentyl pentanoate (amyl valerate) apple Propyl acetate pear Propyl hexanoate blackberry, pineapple...

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C9H18O2

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heptanoate Heptyl acetate Nonanoic acid Pentyl butyrate, or amyl butyrate Propyl hexanoate This set index page lists chemical structure articles associated with...

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C12H24O2

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mass: 200.1776 u) may refer to: Ethyl decanoate Lauric acid Hexyl hexanoate Propyl myristate This set index page lists chemical structure articles associated...

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List of additives in cigarettes

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dl-Alanine Alfalfa extract Allspice extract, oleoresin, and oil Allyl hexanoate Allyl ionone Almond bitter oil Ambergris tincture Ammonia Ammonium bicarbonate...

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Fatty acid

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acid was reduced in the presence of medium-chain fatty acids such as hexanoate, octanoate, and decanoate, but not propionate or butyrate, indicating...

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Drospirenone

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-PREGN-4-EN-21,17-CARBOLACTONE, DRSP), AS WELL AS 7 alpha -(3-HYDROXY-1-PROPYL)-6ss,7ss;15ss,16ss-DIMETHYLENE-5ss-ANDROSTANE-3ss,5,17ss-TRIOL (ZK 92836)...

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Pentenoic acid

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cokeri 2-Methyl-3-pentenoic acid. Some esters are berry fruit flavors. 2-Propyl-trans-2-pentenoic acid (2-en-valproic acid), major metabolite of anticonvulsant...

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Apple

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2-methylbutyl acetate, 1-propyl butyrate, ethyl pentanoate, amyl acetate, 2-methyl-1-butanol, trans-2-hexenal, ethyl hexanoate, hexanol. The apple as a...

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Valproate

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acid, 3-oxovalproic acid via omega oxidation: 5-hydroxyvalproic acid, 2-propyl-glutaric acid some others: 3E-ene-valproic acid, 3Z-ene-valproic acid, 4-ene-valproic...

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List of compounds with carbon number 6

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isothiocyanate 597-97-7 C6H11N2O4PS3 methidathion 950-37-8 C6H11O2Tl thallium hexanoate 34244-90-1 C6H11O3P diallyl hydrogen phosphite 23679-20-1 C6H11O3P ethyl...

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List of compounds with carbon number 16

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octanoate 28043-54-1 C16H30O cyclohexadecanone 2550-52-9 C16H30O2 citronellyl hexanoate 10580-25-3 C16H30O2 palmitoleic acid 373-49-9 C16H30O3 caprylic anhydride...

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