Products Categories
CAS No.: | 25712-33-8 |
---|---|
Name: | trans-1,2-Cyclohexanedimethanol |
Molecular Structure: | |
Formula: | C8H16O2 |
Molecular Weight: | 144.21 |
Synonyms: | trans-1,2-Bis(hydroxymethyl)cyclohexane; |
Density: | 1.004 g/cm3 |
Melting Point: | 55.0 to 59.0 °C |
Boiling Point: | 270.082 °C at 760 mmHg |
Flash Point: | 128.974 °C |
Hazard Symbols: | Xi |
PSA: | 40.46000 |
LogP: | 0.77740 |
What can I do for you?
Get Best Price
The Trans-1,2-cyclohexanedimethanol, with the CAS registry number 25712-33-8, is also known as 1,2-cyclohexanedimethanol, (1R,2R)-. This chemical's molecular formula is C8H16O2 and molecular weight is 144.21. What's more, its systematic name is called (1R,2R)-1,2-Cyclohexanediyldimethanol. When you are dealing with this chemical, you should be very careful. This chemical may cause inflammation to the skin or other mucous membranes.
Physical properties about this chemical are: (1)ACD/LogP: 0.614; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 0.61; (4)ACD/LogD (pH 7.4): 0.61; (5)ACD/BCF (pH 5.5): 1.72; (6)ACD/BCF (pH 7.4): 1.72; (7)ACD/KOC (pH 5.5): 51.39; (8)ACD/KOC (pH 7.4): 51.39; (9)#H bond acceptors: 2; (10)#H bond donors: 2; (11)#Freely Rotating Bonds: 4; (12)Polar Surface Area: 40.46 Å2; (13)Index of Refraction: 1.47; (14)Molar Refractivity: 40.128 cm3; (15)Molar Volume: 143.596 cm3; (16)Polarizability: 15.908×10-24cm3; (17)Surface Tension: 40.56 dyne/cm; (18)Density: 1.004 g/cm3; (19)Flash Point: 128.974 °C; (20)Enthalpy of Vaporization: 59.012 kJ/mol; (21)Boiling Point: 270.082 °C at 760 mmHg; (22)Vapour Pressure: 0.0010 mmHg at 25 °C.
You can still convert the following datas into molecular structure:
(1) SMILES: OC[C@@H]1CCCC[C@H]1CO
(2) InChI: InChI=1S/C8H16O2/c9-5-7-3-1-2-4-8(7)6-10/h7-10H,1-6H2/t7-,8-/m0/s1
(3) InChIKey: XDODWINGEHBYRT-YUMQZZPRSA-N