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Methyl butyrate

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Origin: China

Cas No: 623-42-7

Specification: 99%min

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  • Products Specification
  • Product Description
  • Property

    CAS No.: 623-42-7 Formula: C5H10O2 Molecular Weight: 102.13200

    Description

    Methyl butyrate, also known under the systematic name methyl butanoate, is the methyl ester of butyric acid. Like most esters, it has a fruity odor, in this case resembling apples or pineapples. At room temperature, it is a colorless liquid with low solubility in water, upon which it floats to form an oily layer. Although it is flammable, it has a relatively low vapor pressure (40 mmHg at 30°C (86°F)), so it can be safely handled at room temperature without special safety precautions.
    Methyl butyrate is present in small amounts in several plant products, especially pineapple oil. It can be produced by distillation from essential oils of vegetable origin, but is also manufactured on a small scale for use in perfumes and as a food flavoring.
    Methyl butyrate has been used in combustion studies as a surrogate fuel for the larger fatty acid methyl esters found in biodiesel. However, studies have shown that, due to its short-chain length, methyl butyrate does not reproduce well the negative temperature coefficient (NTC) behaviour and early CO2 formation characteristics of real biodiesel fuels. Therefore, methyl butyrate is not a suitable surrogate fuel for biodiesel combustion studies.

    Basic Info

    Chemical Name Methyl butyrate
    Synonyms

    Butanoic acid, methyl ester;
    methyl butanoate;

    CAS No. 623-42-7
    Molecular Formula C5H10O2
    Molecular Weight 102.13200
    PSA 26.30000
    LogP 0.95950

    Properties

    Appearance & Physical State colorless clear liquid
    Density 0.897
    Boiling Point 102ºC
    Melting Point 11.6ºC
    Flash Point 12ºC
    Refractive Index 1.385-1.39
    Stability Stable. Flammable. Incompatible with strong bases, strong oxidizing agents.
    Storage Condition Flammables area
    Vapor Density 3.5 (vs air)
    Vapor Pressure 40 mm Hg ( 30 °C)

    Safety Info

    RTECS ET5500000
    Hazard Class 3
    Safety Statements S16-S26
    HS Code 2915600000
    WGK Germany 2
    Packing Group II
    RIDADR UN 1237
    Risk Statements R11; R20; R36/37/38
    Hazard Codes F; Xi
    Signal Word Danger
    Symbol GHS02
    Hazard Declaration H225
    Caution Statement P210; P403 + P235

    Synthesis Route

    Methanoloxane+2-METHYLTETRAHYDROPYRAN
    Methanol+N-pivaloylbutyramideMethyl butyrate+2,2-dimethylpropanamide
    Methanol+tributyrinmonobutyrin+α,β-dibutyrine

    Toxicity

    Exposure Route Type of Test Species Observed Dose/Duration Toxic Effects
    Administration onto the skin Standard Draize test Rodent - rabbit 500 mg/24H -
    Oral LD50 - Lethal dose, 50 percent kill Rodent - rat >5 gm/kg 1.Details of toxic effects not reported other than lethal dose value
    Inhalation LC50 - Lethal concentration, 50 percent kill Rodent - mouse 18 gm/m3/2H 1.Details of toxic effects not reported other than lethal dose value

    Downstream Product

    methyl 4-chlorobutanoate
    methyl 2-chlorobutanoate
    5-ethyl-2-sulfanylidene-1H-pyrimidin-4-one
    methyl 3-chlorobutanoate

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