Cas no 3944-37-4 (1-Propanol,2-(1-methylethoxy)-)

1-Propanol,2-(1-methylethoxy)- structure
3944-37-4 structure
Product Name:1-Propanol,2-(1-methylethoxy)-
CAS No:3944-37-4
MF:C6H14O2
MW:118.174162387848
CID:309330
PubChem ID:107196
Update Time:2025-04-19

1-Propanol,2-(1-methylethoxy)- Chemical and Physical Properties

Names and Identifiers

    • 1-Propanol,2-(1-methylethoxy)-
    • 2-propan-2-yloxypropan-1-ol
    • 2-(propan-2-yloxy)propan-1-ol
    • 2-Isopropoxypropanol
    • 1-Propanol, 2-isopropoxy-
    • 2-(1-Methylethoxy)-1-propanol
    • Solvenon IPP
    • 3944-37-4
    • ZFEKANLLFQEKED-UHFFFAOYSA-N
    • 2-[(Propan-2-yl)oxy]propan-1-ol
    • 2-ISOPROPOXYPROPAN-1-OL
    • 2-Isopropoxy-1-propanol
    • DTXSID50960084
    • EINECS 223-534-8
    • SCHEMBL224491
    • NS00050001
    • 1-Propanol, 2-(1-methylethoxy)-
    • Inchi： 1S/C6H14O2/c1-5(2)8-6(3)4-7/h5-7H,4H2,1-3H3
    • InChI Key： ZFEKANLLFQEKED-UHFFFAOYSA-N
    • SMILES： O(C(C)C)C(C)CO

Computed Properties

  • Exact Mass: 118.09942
  • Monoisotopic Mass: 118.099
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 8
  • Rotatable Bond Count: 3
  • Complexity: 52.5
  • 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: 0.6
  • Topological Polar Surface Area: 29.5?2

Experimental Properties

  • Density: 0.893
  • Boiling Point: 147.5°Cat760mmHg
  • Flash Point: 48°C
  • Refractive Index: 1.414
  • PSA: 29.46

1-Propanol,2-(1-methylethoxy)- Related Literature

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