Cas no 1269291-96-4 (3-(propan-2-yl)cyclobutylmethanol)

3-(propan-2-yl)cyclobutylmethanol structure
1269291-96-4 structure
Product Name:3-(propan-2-yl)cyclobutylmethanol
CAS No:1269291-96-4
MF:C8H16O
MW:128.212042808533
MDL:MFCD18801139
CID:1084486
PubChem ID:52911206
Update Time:2025-04-20

3-(propan-2-yl)cyclobutylmethanol Chemical and Physical Properties

Names and Identifiers

    • (3-Isopropylcyclobutyl)methanol
    • (3-propan-2-ylcyclobutyl)methanol
    • AK-77535
    • SureCN254990
    • 3-(propan-2-yl)cyclobutylmethanol
    • EN300-2009676
    • SCHEMBL254990
    • AKOS015841694
    • DTXSID20680560
    • MFCD18801139
    • DA-13080
    • A898550
    • CyclobutaneMethanol, 3-(1-Methylethyl)-
    • 1269291-96-4
    • SCHEMBL10216587
    • SCHEMBL10216419
    • (3-Isopropyl-cyclobutyl)-methanol
    • [3-(Propan-2-yl)cyclobutyl]methanol
    • MDL: MFCD18801139
    • Inchi: 1S/C8H16O/c1-6(2)8-3-7(4-8)5-9/h6-9H,3-5H2,1-2H3
    • InChI Key: FVHPFGGDBCIDRZ-UHFFFAOYSA-N
    • SMILES: OCC1CC(C(C)C)C1

Computed Properties

  • Exact Mass: 128.12
  • Monoisotopic Mass: 128.12
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 1
  • Heavy Atom Count: 9
  • Rotatable Bond Count: 2
  • Complexity: 82.6
  • 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
  • Topological Polar Surface Area: 20.2A^2
  • XLogP3: 1.9

Experimental Properties

  • Density: 0.905±0.06 g/cm3 (20 oC 760 Torr),
  • Boiling Point: 180.4±8.0 oC (760 Torr),
  • Flash Point: 72.4±8.6 oC,
  • Solubility: Slightly soluble (7.4 g/l) (25 o C),
  • PSA: 20.23000
  • LogP: 1.66090

3-(propan-2-yl)cyclobutylmethanol Pricemore >>

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