Cas no 16980-56-6 (Cyclohexanol,4-(1,1-dimethylethyl)-1-methyl-, trans-)

Cyclohexanol,4-(1,1-dimethylethyl)-1-methyl-, trans- structure
16980-56-6 structure
Product Name:Cyclohexanol,4-(1,1-dimethylethyl)-1-methyl-, trans-
CAS No:16980-56-6
MF:C11H22O
MW:170.291783809662
CID:217923
PubChem ID:244766
Update Time:2025-04-19

Cyclohexanol,4-(1,1-dimethylethyl)-1-methyl-, trans- Chemical and Physical Properties

Names and Identifiers

    • Cyclohexanol,4-(1,1-dimethylethyl)-1-methyl-, trans-
    • 4-tert-butyl-1-methylcyclohexan-1-ol
    • 4-t-butyl-1-trans-methyl-1-cyclohexanol
    • cis-4-(tert-Butyl)-1-methylcyclohexan-1-ol
    • cis-4-t-butyl-1-methyl-1-cyclohexanol
    • cis-4-tert.-Butyl-cyclohexylpropylether
    • cis-4-tert-butyl-1-methyl-1-cyclohexanol
    • cis-4-tert-butyl-1-methylcyclohexanol
    • cis-4-tert-Butyl-1-propoxycyclohexan
    • CTK0A2459
    • Cyclohexane, 1-(1,1-dimethylethyl)-4-propoxy-, cis-
    • trans-1-methyl-4-t-butylcyclohexanol
    • trans-4-tert-butyl-1-methylcyclohexanol
    • SCHEMBL12384781
    • 16980-56-6
    • SCHEMBL12384745
    • NSC-55895
    • NSC-405837
    • 1-Cyclohexanol, 4-tert.butyl-1-methyl-
    • EN300-693617
    • cis-4-t-butyl-1-methylcyclohexanol
    • 6353-54-4
    • NSC55895
    • DTXSID40937684
    • SSIUIKNPZLRZLO-UHFFFAOYSA-N
    • 4-tert-Butyl-1-methylcyclohexanol #
    • AKOS009996017
    • NSC405837
    • SCHEMBL10013221
    • Inchi: 1S/C11H22O/c1-10(2,3)9-5-7-11(4,12)8-6-9/h9,12H,5-8H2,1-4H3
    • InChI Key: SSIUIKNPZLRZLO-UHFFFAOYSA-N
    • SMILES: OC1(C)CCC(CC1)C(C)(C)C

Computed Properties

  • Exact Mass: 170.16716
  • Monoisotopic Mass: 170.167
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 1
  • Heavy Atom Count: 12
  • Rotatable Bond Count: 1
  • Complexity: 147
  • 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
  • XLogP3: 3
  • Topological Polar Surface Area: 20.2?2

Experimental Properties

  • Density: 0.905
  • Boiling Point: 213.6°Cat760mmHg
  • Flash Point: 85.9°C
  • Refractive Index: 1.465
  • PSA: 20.23
  • LogP: 2.97370
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