4,4'-Bicyclohexanol
Product Information
Molecular Formula
C12H22O2
Molecular Weight
198.30
Description
4,4'-Bicyclohexanol (CAS# 20601-38-1) is a useful research chemical.
Synonyms
4-(4-hydroxycyclohexyl)-1-cyclohexanol; 4-(4-hydroxycyclohexyl)cyclohexan-1-ol
IUPAC Name
4-(4-hydroxycyclohexyl)cyclohexan-1-ol
SMILES
C1CC(CCC1C2CCC(CC2)O)O
InChI
InChI=1S/C12H22O2/c13-11-5-1-9(2-6-11)10-3-7-12(14)8-4-10/h9-14H,1-8H2
InChI Key
MZXNOAWIRQFYDB-UHFFFAOYSA-N
Boiling Point
324.2 °C / 760 mmHg
Melting Point
184-188 °C
Purity
> 98.0 % (GC)
Density
1.098±0.06 g/cm3(Predicted)
Appearance
White to almost white powder to crystal
Storage
Sealed in dry. Room temperature.
LogP
2.08860
Safety Information
Hazards
H315:
Causes skin irritation.
H319:
Causes serious eye irritation.
Causes skin irritation.
H319:
Causes serious eye irritation.
Precautionary Statement
P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501
Signal Word
Warning
Computed Properties
XLogP3
1.9
Hydrogen Bond Donor Count
2
Hydrogen Bond Acceptor Count
2
Rotatable Bond Count
1
Exact Mass
198.161979940 g/mol
Monoisotopic Mass
198.161979940 g/mol
Topological Polar Surface Area
40.5Ų
Heavy Atom Count
14
Formal Charge
0
Complexity
145
Isotope Atom Count
0
Defined Atom Stereocenter Count
0
Undefined Atom Stereocenter Count
0
Defined Bond Stereocenter Count
0
Undefined Bond Stereocenter Count
0
Covalently-Bonded Unit Count
1
Compound Is Canonicalized
Yes
Patents
| Publication Number | Title | Priority Date |
|---|---|---|
| CN-113912810-A | Single-component aqueous polyurethane dispersion and preparation method thereof | 2021-10-12 |
| CN-112851600-A | Preparation method of high-heat-resistance diepoxide | 2021-01-11 |
| CN-112624932-A | Synthetic method and application of polyurea prepolymer | 2020-12-02 |
| CN-112251240-A | Quaternary ammonium salt ionic liquid crystal polymer with temperature control electronic switch performance and preparation method and application thereof | 2020-10-20 |
| JP-2022021028-A | Polycarbonate resin composition and molded products | 2020-07-21 |
| JP-2022012878-A | Polycarbonate having an electro-optic effect, its manufacturing method, and an optical control element using the polycarbonate. | 2020-07-02 |
| WO-2021233728-A1 | Thermoset polymer powder | 2020-05-19 |
| JP-2021167400-A | An ionic organic compound and a method for producing a nanocarbon material film using this ionic organic compound. | 2020-04-13 |
| JP-2021143201-A | Physical property stabilizer for water-based cosmetics | 2020-04-10 |
| WO-2021172269-A1 | Yellow-dulling remediation agent, cosmetic composition, and yellow-dulling remediation method | 2020-02-28 |
