Cas no 109989-30-2 (Propyl 2-methoxypropanoate)

Propyl 2-methoxypropanoate structure
Propyl 2-methoxypropanoate structure
Product Name:Propyl 2-methoxypropanoate
CAS No:109989-30-2
MF:C7H14O3
MW:146.184262752533
CID:1194425
PubChem ID:21225823
Update Time:2025-04-20

Propyl 2-methoxypropanoate Chemical and Physical Properties

Names and Identifiers

    • Propyl 2-methoxypropanoate
    • SCHEMBL195164
    • 109989-30-2
    • DTXSID30611481
    • Inchi: 1S/C7H14O3/c1-4-5-10-7(8)6(2)9-3/h6H,4-5H2,1-3H3
    • InChI Key: CYIRLFJPTCUCJB-UHFFFAOYSA-N
    • SMILES: O(C(C(C)OC)=O)CCC

Computed Properties

  • Exact Mass: 146.09432
  • Monoisotopic Mass: 146.094294304g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 10
  • Rotatable Bond Count: 5
  • Complexity: 101
  • 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: 1.3
  • Topological Polar Surface Area: 35.5?2

Experimental Properties

  • PSA: 35.53
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