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  • 2-Methyl-1,3-propanediol

    • 2-Methyl-1,3-propanediol

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    Catalog Number
    ACMA00016793
    Product Name
    2-Methyl-1,3-propanediol
    Category
    Polymers
    Description
    Liquid
    IUPAC Name
    2-methylpropane-1,3-diol
    Molecular Weight
    90.12g/mol
    Molecular Formula
    C4H10O2
    Canonical SMILES
    CC(CO)CO
    InChI
    InChI=1S/C4H10O2/c1-4(2-5)3-6/h4-6H,2-3H2,1H3
    InChI Key
    QWGRWMMWNDWRQN-UHFFFAOYSA-N
    Boiling Point
    195.0 °C;211 °C
    Melting Point
    -91.0 °C;-91 °C
    Flash Point
    127 °C (261 °F) - closed cup
    Density
    1.015 g/ cu cm at 25 °C
    Solubility
    In water, greater than or equal to 3000 mg/L at 25 °C;In water, 1.363X10+5 mg/L at 25 °C (est)
    Color/Form
    Liquid;Clear, colorless liquid
    Complexity
    24.7
    Covalently-Bonded Unit Count
    1
    EC Number
    412-350-5;606-809-0;928-935-8
    Exact Mass
    90.06808g/mol
    Formal Charge
    0
    Heavy Atom Count
    6
    Log P
    0.24 (LogP);log Kow = 0.24 at 20 °C
    MeSH Entry Terms
    2-methyl-1,3-propanediol
    Monoisotopic Mass
    90.06808g/mol
    Odor
    Little or no odor
    Other Experimental
    log Kow = -0.6 at 25 °C;Henry's Law constant = 2.3X10-7 atm-cu m/mole at 25 °C (est);Hydroxyl radical reaction rate constant = 1.1X10-11 cu cm/molecule-sec at 25 °C (est)
    Refractive Index
    Index of refraction: 1.4450 at 20 °C/D
    Rotatable Bond Count
    2
    Stability
    Stable under recommended storage conditions.
    UNII
    N8F53B3R4R
    Vapor Density
    3.11
    Vapor Pressure
    0.02 mmHg;2.1X10-2 mm Hg at 25 °C
    XLogP3
    -0.3
    MSDS
    Download MSDS
    COA
    Download COA
    Spec Sheet
    Download Spec Sheet
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