Cas no 56417-63-1 (Isopropyl 3-Bromo-2-oxopropanoate)

Isopropyl 3-Bromo-2-oxopropanoate structure
56417-63-1 structure
Product Name:Isopropyl 3-Bromo-2-oxopropanoate
CAS No:56417-63-1
MF:C6H9BrO3
MW:209.037861585617
CID:835435
PubChem ID:20253626
Update Time:2025-04-19

Isopropyl 3-Bromo-2-oxopropanoate Chemical and Physical Properties

Names and Identifiers

    • Propanoic acid, 3-bromo-2-oxo-, 1-methylethyl ester
    • isopropyl 3-bromo-2-oxopropanoate
    • propan-2-yl 3-bromo-2-oxopropanoate
    • 2-propyl bromopyruvate
    • 3-bromo-2-oxopropionic acid isopropyl ester
    • AG-F-98115
    • CTK5A5105
    • isopropyl 3-bromo-2-oxopropionate
    • isopropyl 3-bromopyruvate
    • iso-propyl 3-bromopyruvate
    • ISOPROPYL BROMOPYRUVATE
    • isopropyl-3-bromo-2-oxopropionale
    • KB-77949
    • DTXSID30604176
    • isopropyl3-bromo-2-oxopropanoate
    • DB-370617
    • CS-16993
    • CS-M0667
    • AKOS028114239
    • MBTUZNKTKYBZQY-UHFFFAOYSA-N
    • 56417-63-1
    • SCHEMBL1242991
    • Isopropyl 3-Bromo-2-oxopropanoate
    • Inchi: 1S/C6H9BrO3/c1-4(2)10-6(9)5(8)3-7/h4H,3H2,1-2H3
    • InChI Key: MBTUZNKTKYBZQY-UHFFFAOYSA-N
    • SMILES: BrCC(C(=O)OC(C)C)=O

Computed Properties

  • Exact Mass: 207.97347
  • Monoisotopic Mass: 207.97351g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 10
  • Rotatable Bond Count: 4
  • Complexity: 142
  • 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: 43.4?2

Experimental Properties

  • Density: Not available
  • Melting Point: Not available
  • Boiling Point: Not available
  • Flash Point: Not available
  • PSA: 43.37
  • Vapor Pressure: Not available

Isopropyl 3-Bromo-2-oxopropanoate Pricemore >>

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