557-00-6
Product Name:
Propyl isovalerate
Formula:
C8H16O2
Synonyms:
Propyl 3-methylbutanoate;Propyl 3-methylbutyrate
Inquiry
CHEMICAL AND PHYSICAL PROPERTIES
| Physical Description | colourless, mobile liquid/fruity odour |
|---|---|
| Boiling Point | 156.00 to 157.00 °C. @ 760.00 mm Hg |
| Solubility | soluble in organic solvents, alcohol; insoluble in water |
| Density | 0.860 - 0.866 |
| Refractive Index | 1.400 - 1.405 |
| Kovats Retention Index | 928 933 926 929 929 930 937 929 934.1 924 924 |
SAFETY INFORMATION
| Signal word | Warning |
|---|---|
| Pictogram(s) |
 Flame Flammables GHS02 |
| GHS Hazard Statements |
H225:Flammable liquids |
| Precautionary Statement Codes |
P210:Keep away from heat/sparks/open flames/hot surfaces. — No smoking. P403+P235:Store in a well-ventilated place. Keep cool. |
COMPUTED DESCRIPTORS
| Molecular Weight | 144.21 g/mol |
|---|---|
| XLogP3 | 2.3 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 2 |
| Rotatable Bond Count | 5 |
| Exact Mass | 144.115029749 g/mol |
| Monoisotopic Mass | 144.115029749 g/mol |
| Topological Polar Surface Area | 26.3 Ų |
| Heavy Atom Count | 10 |
| Formal Charge | 0 |
| Complexity | 97.4 |
| 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
Propyl 3-methylbutanoate is a fatty acid ester.