Cas no 55659-54-6 (1,2-Cyclobutanedimethanol,(1R-trans)- (9CI))

1,2-Cyclobutanedimethanol,(1R-trans)- (9CI) structure
55659-54-6 structure
Product Name:1,2-Cyclobutanedimethanol,(1R-trans)- (9CI)
CAS No:55659-54-6
MF:C6H12O2
MW:116.158282279968
CID:382195
PubChem ID:143291
Update Time:2025-04-19

1,2-Cyclobutanedimethanol,(1R-trans)- (9CI) Chemical and Physical Properties

Names and Identifiers

    • 1,2-Cyclobutanedimethanol,(1R-trans)- (9CI)
    • [1R,2R,(-)]-1,2-Cyclobutanedimethanol
    • 1,2-Cyclobutanedimethanol, trans-
    • NSC135000
    • DTXSID50965716
    • SY270402
    • 55659-54-6
    • CYCLOBUTANE-1,2-DIYLDIMETHANOL
    • (Cyclobutane-1,2-diyl)dimethanol
    • [2-(hydroxymethyl)cyclobutyl]methanol
    • NSC-135000
    • P19699
    • 1,2-BIS-HYDROXYMETHYL-CYCLOBUTANE
    • SCHEMBL260159
    • MFCD09866703
    • BS-43477
    • AKOS015966506
    • 1,2-Cyclobutanedimethanol
    • 5140-07-8
    • CS-0369550
    • Inchi： 1S/C6H12O2/c7-3-5-1-2-6(5)4-8/h5-8H,1-4H2
    • InChI Key： GAADRFVRUBFCML-UHFFFAOYSA-N
    • SMILES： OCC1CCC1CO

Computed Properties

  • Exact Mass: 116.08376
  • Monoisotopic Mass: 116.08373
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 2
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 8
  • Rotatable Bond Count: 2
  • Complexity: 62.9
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 2
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • Topological Polar Surface Area: 40.5
  • XLogP3: -0.1

Experimental Properties

  • Density: 1.074
  • Boiling Point: 250.4°Cat760mmHg
  • Flash Point: 123.1°C
  • PSA: 40.46

1,2-Cyclobutanedimethanol,(1R-trans)- (9CI) Related Literature

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