Cas no 108957-96-6 (N-Isopropyl-N-methylglycine)

N-Isopropyl-N-methylglycine is a synthetic amino acid derivative characterized by its branched alkyl substituents, which impart unique steric and electronic properties. This compound is primarily utilized as a building block in organic synthesis and pharmaceutical research, where its structural features enable tailored modifications to enhance molecular interactions. Its isopropyl and methyl groups contribute to increased lipophilicity, making it valuable in designing peptidomimetics or modifying peptide stability. The compound’s versatility also extends to applications in catalysis and ligand design, where its steric hindrance can influence reaction selectivity. High purity and well-defined stereochemistry are critical for its effective use in precision chemistry applications.
N-Isopropyl-N-methylglycine structure
N-Isopropyl-N-methylglycine structure
Product Name:N-Isopropyl-N-methylglycine
CAS No:108957-96-6
MF:C6H13NO2
MW:131.172921895981
MDL:MFCD09864552
CID:1087355
PubChem ID:22015279
Update Time:2025-06-07

N-Isopropyl-N-methylglycine Chemical and Physical Properties

Names and Identifiers

    • 2-(Isopropyl(methyl)amino)acetic acid
    • 2-[methyl(propan-2-yl)amino]acetic acid
    • N-Isopropyl-N-methylglycine
    • N-isopropyl-N-methylglycine(SALTDATA: FREE)
    • UKRORGSYN-BB BBR-042273
    • N-Methyl-N-(1-methylethyl)glycine
    • 2-(isopropyl-methylamino)acetic acid
    • 2-(isopropyl-methyl-amino)acetic acid
    • 2-(methyl-propan-2-yl-amino)ethanoic acid
    • AKOS009234891
    • Glycine, N-methyl-N-(1-methylethyl)-
    • N-Methyl-N-propan-2-ylglycine
    • SCHEMBL867753
    • ALBB-028772
    • AB01004769-01
    • CS-0037772
    • 2-[methyl(propan-2-yl)azaniumyl]acetate
    • 2-(Isopropyl(methyl)amino)aceticacid
    • DB-371587
    • 108957-96-6
    • [ISOPROPYL(METHYL)AMINO]ACETIC ACID
    • AS-39574
    • DTXSID60621513
    • MFCD09864552
    • MDL: MFCD09864552
    • Inchi: 1S/C6H13NO2/c1-5(2)7(3)4-6(8)9/h5H,4H2,1-3H3,(H,8,9)
    • InChI Key: RMLIHPQMHVOHNZ-UHFFFAOYSA-N
    • SMILES: OC(CN(C)C(C)C)=O

Computed Properties

  • Exact Mass: 131.09500
  • Monoisotopic Mass: 131.094628657g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 9
  • Rotatable Bond Count: 3
  • Complexity: 101
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: -1.6
  • Topological Polar Surface Area: 40.5?2

Experimental Properties

  • PSA: 40.54000
  • LogP: 0.41120

N-Isopropyl-N-methylglycine Customs Data

  • HS CODE:2922499990
  • Customs Data:

    China Customs Code:

    2922499990

    Overview:

    2922499990 Other amino acids and their esters and their salts(Except those containing more than one oxygen-containing group). VAT:17.0% Tax refund rate:9.0% Regulatory conditions:AB(Customs clearance form for Inbound Goods,Customs clearance form for outbound goods) MFN tariff:6.5% general tariff:30.0%

    Declaration elements:

    Product Name, component content, use to, The color of ethanolamine and its salt should be reported, The package of ethanolamine and its salt shall be declared

    Regulatory conditions:

    A.Customs clearance form for Inbound Goods
    B.Customs clearance form for outbound goods

    Inspection and quarantine category:

    P.Imported animals and plants\Quarantine of animal and plant products
    Q.Outbound animals and plants\Quarantine of animal and plant products
    R.Sanitary supervision and inspection of imported food
    S.Sanitary supervision and inspection of exported food
    M.Import commodity inspection
    N.Export commodity inspection

    Summary:

    HS:2922499990 other amino-acids, other than those containing more than one kind of oxygen function, and their esters; salts thereof VAT:17.0% Tax rebate rate:9.0% Supervision conditions:AB(certificate of inspection for goods inward,certificate of inspection for goods outward) MFN tariff:6.5% General tariff:30.0%

N-Isopropyl-N-methylglycine Pricemore >>

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