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624-24-8

624-24-8 structural image
Product Name: METHYL VALERATE
Formula: C6H12O2
Synonyms: Methyl pentanoate
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CHEMICAL AND PHYSICAL PROPERTIES

Physical Description Methyl valerate is a clear colorless to yellowish oily liquid. (NTP, 1992)
Boiling Point 259.7 °F at 760 mmHg (NTP, 1992)
Flash Point 72 °F (NTP, 1992)
Solubility less than 1 mg/mL at 72 °F (NTP, 1992)
Density 0.8947 at 68 °F (NTP, 1992) - Less dense than water; will float
Vapor Pressure 63 mmHg at 124 °F ; 262 mmHg at 167 °F; 320 mmHg at 199 °F (NTP, 1992)
LogP 1.96
Refractive Index 1.393-1.399
Kovats Retention Index 804 808 808.8 807 852 809 808 806 810 802 807 816 807 812 814 800 807 808 806 801.8 811 806 810 810 807 808 806.1 806 821 807.9 804.7

SAFETY INFORMATION

Signal word Warning
Pictogram(s)

Flame
Flammables
GHS02

Exclamation Mark
Irritant
GHS07
GHS Hazard Statements H226:Flammable liquids
H317:Sensitisation, Skin
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.
P241:Use explosion-proof electrical/ventilating/lighting/…/equipment.
P280:Wear protective gloves/protective clothing/eye protection/face protection.
P303+P361+P353:IF ON SKIN (or hair): Remove/Take off Immediately all contaminated clothing. Rinse SKIN with water/shower.

COMPUTED DESCRIPTORS

Molecular Weight 116.16 g/mol
XLogP3 2
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 2
Rotatable Bond Count 4
Exact Mass 116.083729621 g/mol
Monoisotopic Mass 116.083729621 g/mol
Topological Polar Surface Area 26.3 Ų
Heavy Atom Count 8
Formal Charge 0
Complexity 68.9
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

Methyl valerate is a clear colorless to yellowish oily liquid. (NTP, 1992)