Cas no 39149-65-0 (tert-butyl 2-methyl-3-oxobutanoate)

tert-butyl 2-methyl-3-oxobutanoate structure
39149-65-0 structure
Product Name:tert-butyl 2-methyl-3-oxobutanoate
CAS No:39149-65-0
MF:C9H16O3
MW:172.221543312073
MDL:MFCD03425856
CID:297431
PubChem ID:11745089
Update Time:2025-04-19

tert-butyl 2-methyl-3-oxobutanoate Chemical and Physical Properties

Names and Identifiers

    • Butanoic acid,2-methyl-3-oxo-, 1,1-dimethylethyl ester
    • TERT.-BUTYL 2-METHYL-3-OXOBUTANOATE
    • TERT-BUTYL 2-METHYL-3-OXOBUTANOATE
    • 2-methyl-3-oxo-butyric acid tert-butyl ester
    • 2-Methylacetoacetic acid tert-butylester
    • Acetoaceticacid,2-methyl-,tert-butyl ester (7CI)
    • tert-Butyl 2-methylacetoacetate
    • tert-Butyl a-methylacetoacetate
    • EN300-260455
    • AKOS006279190
    • MFCD03425856
    • SCHEMBL1141948
    • Butanoic acid, 2-methyl-3-oxo-, 1,1-dimethylethyl ester
    • QIFZMFUCASLNCC-UHFFFAOYSA-N
    • D84436
    • A934990
    • CS-0243192
    • 39149-65-0
    • DTXSID90471629
    • t-butyl 2-methyl-3-oxobutanoate
    • tert-butyl 2-methyl-3-oxobutanoate
    • MDL: MFCD03425856
    • Inchi: 1S/C9H16O3/c1-6(7(2)10)8(11)12-9(3,4)5/h6H,1-5H3
    • InChI Key: QIFZMFUCASLNCC-UHFFFAOYSA-N
    • SMILES: O(C(C(C(C)=O)C)=O)C(C)(C)C

Computed Properties

  • Exact Mass: 172.11000
  • Monoisotopic Mass: 172.109944368g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 12
  • Rotatable Bond Count: 4
  • Complexity: 188
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 1
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: 1.5
  • Topological Polar Surface Area: 43.4?2

Experimental Properties

  • PSA: 43.37000
  • LogP: 1.55320

tert-butyl 2-methyl-3-oxobutanoate Customs Data

  • HS CODE:2918300090
  • Customs Data:

    China Customs Code:

    2918300090

    Overview:

    2918300090 Other aldehydes or ketones without other oxy carboxylic acids(Including anhydrides\Acyl halide\Peroxides, peroxyacids and derivatives of this tax number). VAT:17.0% Tax refund rate:9.0% Regulatory conditions:nothing MFN tariff:6.5% general tariff:30.0%

    Declaration elements:

    Product Name, component content, use to

    Summary:

    2918300090 other carboxylic acids with aldehyde or ketone function but without other oxygen function, their anhydrides, halides, peroxides, peroxyacids and their derivatives.Supervision conditions:None.VAT:17.0%.Tax rebate rate:9.0%.MFN tariff:6.5%.General tariff:30.0%

tert-butyl 2-methyl-3-oxobutanoate Pricemore >>

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