Basic Information | Post buying leads | Suppliers | Cas Database |
Name |
4,4'-Bicyclohexanol |
EINECS | 243-908-4 |
CAS No. | 20601-38-1 | Density | 1.098 g/cm3 |
PSA | 40.46000 | LogP | 2.08860 |
Solubility | N/A | Melting Point |
184-188 °C |
Formula | C12H22O2 | Boiling Point | 324.173 °C at 760 mmHg |
Molecular Weight | 198.305 | Flash Point | 151.532 °C |
Transport Information | N/A | Appearance | N/A |
Safety | 26-36 | Risk Codes | 36/37/38 |
Molecular Structure | Hazard Symbols | Xi | |
Synonyms |
[Bicyclohexyl]-4,4'-diol(6CI,8CI);4,4'-Bicyclohexanediol;4,4'-Dihydroxybicyclohexyl;4,4'-Dihydroxydicyclohexane;Bis(4-hydroxycyclohexyl); |
Article Data | 13 |
The 4,4'-Bicyclohexanol with CAS registry number of 20601-38-1 is also known as Bicyclohexylacetophenone. The systematic name is 1,1'-Bi(cyclohexyl)-4,4'-diol. Its EINECS registry number is 243-908-4. In addition, the formula is C12H22O2 and the molecular weight is 198.30.
Physical properties about 4,4'-Bicyclohexanol are: (1)ACD/LogP: 1.85; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 1.85; (4)ACD/LogD (pH 7.4): 1.85; (5)ACD/BCF (pH 5.5): 14.93; (6)ACD/BCF (pH 7.4): 14.93; (7)ACD/KOC (pH 5.5): 241; (8)ACD/KOC (pH 7.4): 241; (9)#H bond acceptors: 2; (10)#H bond donors: 2; (11)#Freely Rotating Bonds: 3; (12)Polar Surface Area: 18.46Å2; (13)Index of Refraction: 1.539; (14)Molar Refractivity: 56.56 cm3; (15)Molar Volume: 180.5 cm3; (16)Polarizability: 22.42×10-24cm3; (17)Surface Tension: 42.1 dyne/cm; (18)Density: 1.098 g/cm3; (19)Flash Point: 151.5 °C; (20)Enthalpy of Vaporization: 65.62 kJ/mol; (21)Boiling Point: 324.2 °C at 760 mmHg; (22)Vapour Pressure: 1.95E-05 mmHg at 25 °C.
When you are using this chemical, please be cautious about it. As a chemical, it is irritating to eyes, respiratory system and skin. During using it, wear suitable protective clothing. In case of contact with eyes, rinse immediately with plenty of water and seek medical advice.
You can still convert the following datas into molecular structure:
1. SMILES: OC2CCC(C1CCC(O)CC1)CC2
2. InChI: InChI=1/C12H22O2/c13-11-5-1-9(2-6-11)10-3-7-12(14)8-4-10/h9-14H,1-8H2
3. InChIKey: MZXNOAWIRQFYDB-UHFFFAOYAS