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108-84-9

108-84-9 structural image
Product Name: 1,3-DIMETHYLBUTYL ACETATE
Formula: C8H16O2
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CHEMICAL AND PHYSICAL PROPERTIES

Physical Description Methylamyl acetate appears as a clear colorless liquid. Flash point 95 °F. Less dense than water and insoluble in water. Vapors heavier than air.
Color/Form Colorless liquid.
Odor Mild, pleasant, fruity odor.
Boiling Point 295.2 °F at 760 mmHg (USCG, 1999)
Melting Point -82.8 °F (USCG, 1999)
Flash Point 113 °F (USCG, 1999)
Solubility 0.08 % (NIOSH, 2023)
Density 0.86 at 68 °F (USCG, 1999) - Less dense than water; will float
Vapor Density 5.0 (AIR= 1)
Vapor Pressure 10.86 mmHg (USCG, 1999)
Autoignition Temperature 510 °F (USCG, 1999)
Viscosity Viscosity coefficient = 0.93 cP at 20 °C
Heat of Combustion -14,400 BTU/LB= -8,000 CAL/G= -335 X 10+5 J/KG
Heat of Vaporization 225 BTU/LB= 125 CAL/G= 5.23X10+5 J/KG
Surface Tension 25 DYNES/CM= 0.025 N/M AT 25 °C
Odor Threshold Odor Threshold Low: 0.39 [mmHg] Odor threshold from AIHA
Refractive Index INDEX OF REFRACTION: 1.3980 @ 20 °C/D
Kovats Retention Index 885.1 885
Other Experimental Properties 1 PPM= 5.89 MG/CU M
Chemical Classes Solvents -> Esters (<C12)

SAFETY INFORMATION

Signal word Warning
Pictogram(s)

Flame
Flammables
GHS02

Exclamation Mark
Irritant
GHS07
GHS Hazard Statements H226:Flammable liquids
H315:Skin corrosion/irritation
H320:Serious eye damage/eye irritation
Precautionary Statement Codes P210:Keep away from heat/sparks/open flames/hot surfaces. — No smoking.
P233:Keep container tightly closed.
P240:Ground/bond container and receiving equipment.
P261:Avoid breathing dust/fume/gas/mist/vapours/spray.
P264:Wash hands thoroughly after handling.
P264:Wash skin thouroughly after handling.
P271:Use only outdoors or in a well-ventilated area.
P280:Wear protective gloves/protective clothing/eye protection/face protection.
P370+P378:In case of fire: Use … for extinction.
P405:Store locked up.
P403+P233:Store in a well-ventilated place. Keep container tightly closed.
P501:Dispose of contents/container to..…

COMPUTED DESCRIPTORS

Molecular Weight 144.21 g/mol
XLogP3 2.2
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 2
Rotatable Bond Count 4
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 108
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 1
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes

PRODUCT INTRODUCTION

description

Methylamyl acetate appears as a clear colorless liquid. Flash point 95 °F. Less dense than water and insoluble in water. Vapors heavier than air.