Cas no 155348-06-4 (4-(2-Hydroxypropan-2-yl)-1-methylcyclohexane-1,3-diol)

4-(2-Hydroxypropan-2-yl)-1-methylcyclohexane-1,3-diol structure
155348-06-4 structure
Product Name:4-(2-Hydroxypropan-2-yl)-1-methylcyclohexane-1,3-diol
CAS No:155348-06-4
MF:C10H20O3
MW:188.264003753662
CID:98018
PubChem ID:71307309
Update Time:2025-04-18

4-(2-Hydroxypropan-2-yl)-1-methylcyclohexane-1,3-diol Chemical and Physical Properties

Names and Identifiers

    • 4-(2-Hydroxypropan-2-yl)-1-methylcyclohexane-1,3-diol
    • 1,3-Cyclohexanediol,4-(1-hydroxy-1-methylethyl)-1-methyl-, [1S-(1a,3a,4a)]- (9CI)
    • P-MENTHANE-1,3,8-TRIOL
    • [ "" ]
    • p-Menthane-1,3,8-triol;4-(2-Hydroxypropan-2-yl)-1-Methylcyclohexane-1,3-diol
    • AKOS022184671
    • 155348-06-4
    • 1,3-Cyclohexanediol, 4-(1-hydroxy-1-methylethyl)-1-methyl-, [1S-(1alpha,3alpha,4alpha)]- (9CI)
    • Inchi: 1S/C10H20O3/c1-9(2,12)7-4-5-10(3,13)6-8(7)11/h7-8,11-13H,4-6H2,1-3H3
    • InChI Key: JRNAYJOJYCECDH-UHFFFAOYSA-N
    • SMILES: OC1CC(C)(CCC1C(C)(C)O)O

Computed Properties

  • Exact Mass: 188.14124450g/mol
  • Monoisotopic Mass: 188.14124450g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 3
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 13
  • Rotatable Bond Count: 1
  • Complexity: 191
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 3
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: 0.8
  • Topological Polar Surface Area: 60.7?2

Experimental Properties

  • Color/Form: Oil
  • Density: 1.1±0.1 g/cm3
  • Boiling Point: 312.9±27.0 °C at 760 mmHg
  • Flash Point: 147.4±18.3 °C
  • PSA: 60.69000
  • LogP: 0.66930
  • Vapor Pressure: 0.0±1.5 mmHg at 25°C

4-(2-Hydroxypropan-2-yl)-1-methylcyclohexane-1,3-diol Security Information

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