Cas no 3039-96-1 (1,3-Cyclobutanediol,2,2,4,4-tetramethyl-, cis-)

1,3-Cyclobutanediol,2,2,4,4-tetramethyl-, cis- structure
3039-96-1 structure
Product Name:1,3-Cyclobutanediol,2,2,4,4-tetramethyl-, cis-
CAS No:3039-96-1
MF:C8H16O2
MW:144.211442947388
CID:315454
PubChem ID:76382
Update Time:2025-04-19

1,3-Cyclobutanediol,2,2,4,4-tetramethyl-, cis- Chemical and Physical Properties

Names and Identifiers

    • 1,3-Cyclobutanediol,2,2,4,4-tetramethyl-, cis-
    • cis-2,2,4,4-Tetramethyl-1,3-cyclobutanediol
    • 1,3-Cyclobutanedithione,2,2,4,4-tetramethyl-
    • 2,2,4,4-tetramethylcyclobuta-1,3-dithione
    • 2,2,4,4-tetramethylcyclobutan-1,3-dithione
    • 2,2,4,4-tetramethylcyclobutan-1,3-thione
    • 2,2,4,4-tetramethyl-cyclobutan-cis-1,3-diol
    • 2,2,4,4-tetramethyl-cyclobutane-1,3-dithione
    • AC1L3E9W
    • cis-2,2,4,4
    • cis-2,2,4,4-Tetramethyl-cyclobutan-1,3-diol
    • cis-2.2.4.4-Tetramethyl-cyclobutandiol-(1.3)
    • NSC361243
    • Tetramethyl-1,3-cyclobutanedithione
    • FQXGHZNSUOHCLO-UHFFFAOYSA-
    • DTXCID7024908
    • DTXSID301263004
    • 1,3-Cyclobutanediol, 2,2,4,4-tetramethyl-
    • NCIOpen2_001301
    • SCHEMBL270140
    • NCGC00256202-01
    • cis-2,2,4,4-tetramethylcyclobutane-1,3-diol
    • NSC92373
    • NSC-92373
    • 2,2,4,4-Tetramethyl-1,3-cyclobutanediol,c&t
    • AS-10568
    • 2.2.4.4-Tetramethyl-1-3-cyclo-butanediol
    • AI3-26279
    • FQXGHZNSUOHCLO-OLQVQODUSA-N
    • V7WK40I307
    • 2694-23-7
    • 2,2,4,4-Tetramethyl-1,3-cyclobutanediol, cis-
    • CS-0153881
    • Tox21_301614
    • 3039-96-1
    • NSC-46473
    • 2,2,4,4-tetramethylcyclobutane-1,3-diol
    • UNII-V3G697089H
    • AT23587
    • UNII-9T56625HW3
    • V3G697089H
    • AT13091
    • cis-2,4,4-Tetramethyl-1,3-cyclobutanediol
    • 2,2,4,4-Tetramethyl-1,3-cyclobutanediol, trans-
    • J-017783
    • InChI=1/C8H16O2/c1-7(2)5(9)8(3,4)6(7)10/h5-6,9-10H,1-4H3
    • UNII-V7WK40I307
    • EC 221-140-0
    • SCHEMBL9880641
    • MFCD00001329
    • 2,2,4,4-tetramethycyclobutane-1,3-diol
    • 1,3-Cyclobutanediol, 2,2,4,4-tetramethyl-, trans-
    • 2,4-dihydroxy-1,1,3,3-tetramethylcyclobutane
    • starbld0034661
    • 1, 2,2,4,4-tetramethyl-, cis-
    • Tetramethyl-1,3-cyclobutanediol
    • 1,1,3,3-Tetramethylcyclobutanediol
    • 2,2,4,4-Tetramethylcyclobutane-1,3-diol, cis
    • 1,3-Cyclobutanediol, 2,2,4,4-tetramethyl-, cis-
    • 1,3,3-Tetramethylcyclobutanediol
    • NSC 92373
    • 2,2,4,4-Tetramethyl-1,3-cyclobutanediol
    • AKOS015842160
    • trans-2,2,4,4-tetramethylcyclobutane-1,3-diol
    • EN300-718454
    • 2,2,4,4-Tetramethylcyclobutane-1,3-diol, trans
    • NS00006132
    • 9T56625HW3
    • EN300-343680
    • CAS-3010-96-6
    • 2,4,4-Tetramethyl-1,3-cyclobutanediol
    • T0145
    • 3010-96-6
    • CHEMBL3186932
    • FT-0609100
    • DTXSID9044908
    • Q27291490
    • EINECS 221-140-0
    • Methyl (4-hydroxy-5-methoxy-2-[2-(methylamino)ethyl]phenyl)acetate
    • trans-2,2,4,4-Tetramethyl-1,3-cyclobutanediol
    • Q3214022
    • NSC46473
    • SCHEMBL45446
    • SCHEMBL268408
    • NSC 46473
    • SCHEMBL5598585
    • 2,2,4,4-Tetramethylcyclobutane-1,3-diol, cis-
    • (1R,3r)-2,2,4,4-tetramethylcyclobutane-1,3-diol
    • Inchi： 1S/C8H16O2/c1-7(2)5(9)8(3,4)6(7)10/h5-6,9-10H,1-4H3
    • InChI Key： FQXGHZNSUOHCLO-UHFFFAOYSA-N
    • SMILES： OC1C(C)(C)C(C1(C)C)O

Computed Properties

  • Exact Mass: 144.11508
  • Monoisotopic Mass: 144.115
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 2
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 10
  • Rotatable Bond Count: 0
  • Complexity: 115
  • 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: 40.5A^2
  • XLogP3: 1.1

Experimental Properties

  • Color/Form: White crystalline powder
  • Density: 1.017
  • Melting Point: 126-129?°C(lit.)
  • Boiling Point: 210-215?°C(lit.)
  • Flash Point: 96.8°C
  • Refractive Index: 1.479
  • PSA: 40.46
  • LogP: 0.77420

1,3-Cyclobutanediol,2,2,4,4-tetramethyl-, cis- Security Information

  • Storage Condition：Flammable area

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