2,6-Di-tert-butyl-4-methylcyclohexanol - CAS 163119-16-2
Catalog: |
BB011944 |
Product Name: |
2,6-Di-tert-butyl-4-methylcyclohexanol |
CAS: |
163119-16-2 |
Synonyms: |
2,6-ditert-butyl-4-methyl-1-cyclohexanol; 2,6-ditert-butyl-4-methylcyclohexan-1-ol |
IUPAC Name: | 2,6-ditert-butyl-4-methylcyclohexan-1-ol |
Description: | 2,6-Di-tert-butyl-4-methylcyclohexanol (CAS# 163119-16-2) is a useful research chemical. |
Molecular Weight: | 226.40 |
Molecular Formula: | C15H30O |
Canonical SMILES: | CC1CC(C(C(C1)C(C)(C)C)O)C(C)(C)C |
InChI: | InChI=1S/C15H30O/c1-10-8-11(14(2,3)4)13(16)12(9-10)15(5,6)7/h10-13,16H,8-9H2,1-7H3 |
InChI Key: | OIXQKWDQCODZGF-UHFFFAOYSA-N |
Boiling Point: | 270 °C |
Density: | 0.884 g/cm3 |
MDL: | MFCD00278493 |
LogP: | 4.10180 |
Publication Number | Title | Priority Date |
CN-111662157-A | Method for synthesizing 2, 6-di-tert-butyl-4-methylcyclohexanol by cobalt catalysis | 20200618 |
CN-111348986-A | Synthesis method of 2, 6-di-tert-butyl-4-methylcyclohexanol compound | 20200415 |
CN-212451250-U | Production system of (1R,2R,6S) -2, 6-di-tert-butyl-4-methylcyclohexanol | 20200229 |
EP-3666853-A1 | Liquid-crystal medium | 20181210 |
US-2020181493-A1 | Liquid-crystal medium | 20181210 |
Complexity: | 207 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 226.229665576 |
Formal Charge: | 0 |
Heavy Atom Count: | 16 |
Hydrogen Bond Acceptor Count: | 1 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 226.229665576 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 20.2 |
Undefined Atom Stereocenter Count: | 2 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 4.9 |
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