2396-84-1
Product Name:
ETHYL SORBATE
Formula:
C8H12O2
Synonyms:
Ethyl trans,trans-2,4-hexadienoate
Inquiry
CHEMICAL AND PHYSICAL PROPERTIES
Physical Description | Colourless liquid; warm, fruity aroma |
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Solubility | Slightly soluble in water; miscible in oils |
Density | 0.936-0.939 |
Refractive Index | 1.491-1.498 |
Kovats Retention Index | 1071 1075 1066 1075 1067 1075 1070 1072 1075 |
SAFETY INFORMATION
Signal word | Warning |
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Pictogram(s) |
Exclamation Mark Irritant GHS07 Health Hazard GHS08 Environment GHS09 |
GHS Hazard Statements |
H227:Flammable liquids |
Precautionary Statement Codes |
P403+P235:Store in a well-ventilated place. Keep cool. |
COMPUTED DESCRIPTORS
Molecular Weight | 140.18 g/mol |
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XLogP3 | 1.9 |
Hydrogen Bond Donor Count | 0 |
Hydrogen Bond Acceptor Count | 2 |
Rotatable Bond Count | 4 |
Exact Mass | 140.083729621 g/mol |
Monoisotopic Mass | 140.083729621 g/mol |
Topological Polar Surface Area | 26.3 Ų |
Heavy Atom Count | 10 |
Formal Charge | 0 |
Complexity | 145 |
Isotope Atom Count | 0 |
Defined Atom Stereocenter Count | 0 |
Undefined Atom Stereocenter Count | 0 |
Defined Bond Stereocenter Count | 2 |
Undefined Bond Stereocenter Count | 0 |
Covalently-Bonded Unit Count | 1 |
Compound Is Canonicalized | Yes |
PRODUCT INTRODUCTION
description
Ethyl sorbate is a fatty acid ester obtained by formal condensation of the carboxy group of sorbic acid and the hydroxy group of ethanol. It has a role as a metabolite. It is functionally related to a sorbic acid.