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    Chemistry

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    Also known as: 51234-98-1, Sodium;n-cyano-n-methylcarbamate, Dtxsid40199245, Einecs 257-073-9
    Molecular Formula
    C3H3N2NaO2
    Molecular Weight
    122.06  g/mol
    InChI Key
    UVJYATLICUROFI-UHFFFAOYSA-M
    CAS 51234-98-1
    1 2D Structure

    CAS 51234-98-1

    2 Identification
    2.1 Computed Descriptors
    2.1.1 IUPAC Name
    sodium;N-cyano-N-methylcarbamate
    2.1.2 InChI
    InChI=1S/C3H4N2O2.Na/c1-5(2-4)3(6)7;/h1H3,(H,6,7);/q;+1/p-1
    2.1.3 InChI Key
    UVJYATLICUROFI-UHFFFAOYSA-M
    2.1.4 Canonical SMILES
    CN(C#N)C(=O)[O-].[Na+]
    2.2 Synonyms
    2.2.1 Depositor-Supplied Synonyms

    1. 51234-98-1

    2. Sodium;n-cyano-n-methylcarbamate

    3. Dtxsid40199245

    4. Einecs 257-073-9

    2.3 Create Date
    2009-08-20
    3 Chemical and Physical Properties
    Molecular Weight 122.06 g/mol
    Molecular Formula C3H3N2NaO2
    Hydrogen Bond Donor Count0
    Hydrogen Bond Acceptor Count3
    Rotatable Bond Count0
    Exact Mass122.00922162 g/mol
    Monoisotopic Mass122.00922162 g/mol
    Topological Polar Surface Area67.2 Ų
    Heavy Atom Count8
    Formal Charge0
    Complexity127
    Isotope Atom Count0
    Defined Atom Stereocenter Count0
    Undefined Atom Stereocenter Count0
    Defined Bond Stereocenter Count0
    Undefined Bond Stereocenter Count0
    Covalently Bonded Unit Count2

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