540-07-8
Product Name:
PENTYL HEXANOATE
Formula:
C11H22O2
Synonyms:
n-Pentyl hexanoate;Amyl caproate;Hexanoic acid pentyl ester;Pentyl caproate
Inquiry
CHEMICAL AND PHYSICAL PROPERTIES
Physical Description | Liquid |
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Melting Point | -47 °C |
Solubility | soluble in alcohol, propylene glycol, fixed oils: insoluble in glycerol, water |
Density | 0.858-0.863 |
Refractive Index | 1.418-1.422 |
Kovats Retention Index | 1270 1273 1270 1270 1272 1274 1246 1246 1272 1268 1246 1277 1279 |
SAFETY INFORMATION
Signal word | Warning |
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Pictogram(s) |
Exclamation Mark Irritant GHS07 |
GHS Hazard Statements |
H315:Skin corrosion/irritation H319:Serious eye damage/eye irritation |
Precautionary Statement Codes |
P264:Wash hands thoroughly after handling. P264:Wash skin thouroughly after handling. P280:Wear protective gloves/protective clothing/eye protection/face protection. P302+P352:IF ON SKIN: wash with plenty of soap and water. P305+P351+P338:IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continuerinsing. P332+P313:IF SKIN irritation occurs: Get medical advice/attention. P337+P313:IF eye irritation persists: Get medical advice/attention. |
COMPUTED DESCRIPTORS
Molecular Weight | 186.29 g/mol |
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XLogP3 | 3.8 |
Hydrogen Bond Donor Count | 0 |
Hydrogen Bond Acceptor Count | 2 |
Rotatable Bond Count | 9 |
Exact Mass | 186.161979940 g/mol |
Monoisotopic Mass | 186.161979940 g/mol |
Topological Polar Surface Area | 26.3 Ų |
Heavy Atom Count | 13 |
Formal Charge | 0 |
Complexity | 121 |
Isotope Atom Count | 0 |
Defined Atom Stereocenter Count | 0 |
Undefined Atom Stereocenter Count | 0 |
Defined Bond Stereocenter Count | 0 |
Undefined Bond Stereocenter Count | 0 |
Covalently-Bonded Unit Count | 1 |
Compound Is Canonicalized | Yes |
PRODUCT INTRODUCTION
description
Valeryl hexanoate is a fatty acid ester.