Cas no 2854-10-6 (tert-butyl 4-oxopentanoate)

tert-butyl 4-oxopentanoate structure
tert-butyl 4-oxopentanoate structure
Product Name:tert-butyl 4-oxopentanoate
CAS No:2854-10-6
MF:C9H16O3
MW:172.221543312073
MDL:MFCD24688249
CID:1435306
PubChem ID:15577827
Update Time:2025-04-20

tert-butyl 4-oxopentanoate Chemical and Physical Properties

Names and Identifiers

    • Pentanoic acid, 4-oxo-, 1,1-dimethylethyl ester
    • levulinic acid t-butyl ester
    • t-Butyl levulinat
    • t-butyl levulinate
    • tert-butyl 4-oxopentanoate
    • DA-48515
    • 2854-10-6
    • tert-butyl4-oxopentanoate
    • FVXIMLWFYMZNEU-UHFFFAOYSA-N
    • SCHEMBL3630266
    • DTXSID00574731
    • CAA85410
    • EN300-300332
    • BS-50078
    • MDL： MFCD24688249
    • Inchi： 1S/C9H16O3/c1-7(10)5-6-8(11)12-9(2,3)4/h5-6H2,1-4H3
    • InChI Key： FVXIMLWFYMZNEU-UHFFFAOYSA-N
    • SMILES： O(C(CCC(C)=O)=O)C(C)(C)C

Computed Properties

  • Exact Mass: 172.11000
  • Monoisotopic Mass: 172.109944368 g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 12
  • Rotatable Bond Count: 5
  • Complexity: 177
  • 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
  • Molecular Weight: 172.22
  • XLogP3: 0.7
  • Topological Polar Surface Area: 43.4?2

Experimental Properties

  • PSA: 43.37000
  • LogP: 1.69730

tert-butyl 4-oxopentanoate Pricemore >>

Related Categories No. Product Name Cas No. Purity Specification Price update time Inquiry
Enamine
EN300-300332-1g
tert-butyl 4-oxopentanoate
 2854-10-6 80%
1g
 $699.0 2023-09-06
Enamine
EN300-300332-5g
tert-butyl 4-oxopentanoate
 2854-10-6 80%
5g
 $2028.0 2023-09-06
Enamine
EN300-300332-10g
tert-butyl 4-oxopentanoate
 2854-10-6 80%
10g
 $3007.0 2023-09-06
Ambeed
A261673-100mg
tert-Butyl 4-oxopentanoate
 2854-10-6 97%
100mg
 $65.0 2025-03-05
Ambeed
A261673-250mg
tert-Butyl 4-oxopentanoate
 2854-10-6 97%
250mg
 $108.0 2025-03-05
Ambeed
A261673-1g
tert-Butyl 4-oxopentanoate
 2854-10-6 97%
1g
 $286.0 2025-03-05
Enamine
EN300-300332-0.05g
tert-butyl 4-oxopentanoate
 2854-10-6 95.0%
0.05g
 $118.0 2025-03-19
Enamine
EN300-300332-0.1g
tert-butyl 4-oxopentanoate
 2854-10-6 95.0%
0.1g
 $175.0 2025-03-19
Enamine
EN300-300332-0.25g
tert-butyl 4-oxopentanoate
 2854-10-6 95.0%
0.25g
 $251.0 2025-03-19
Enamine
EN300-300332-0.5g
tert-butyl 4-oxopentanoate
 2854-10-6 95.0%
0.5g
 $395.0 2025-03-19

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