Basic Information | Post buying leads | Suppliers |
Name |
5,5-Bis(propan-2-ylsulfanyl)pentane-1,2,3-triol |
EINECS | N/A |
CAS No. | 6301-46-8 | Density | 1.154 g/cm3 |
PSA | 111.29000 | LogP | 1.69990 |
Solubility | N/A | Melting Point |
N/A |
Formula | C11H24O3S2 | Boiling Point | 444.3 °C at 760 mmHg |
Molecular Weight | 268.442 | Flash Point | 215.6 °C |
Transport Information | N/A | Appearance | N/A |
Safety | Risk Codes | N/A | |
Molecular Structure | Hazard Symbols | N/A | |
Synonyms |
5,5-bis(propan-2-ylsulfanyl)pentane-1,2,3-triol |
The CAS register number of 5,5-Bis(propan-2-ylsulfanyl)pentane-1,2,3-triol is 6301-46-8. The molecular formula about this chemical is C11H24O3S2 and the molecular weight is 268.4365.
Physical properties about 5,5-Bis(propan-2-ylsulfanyl)pentane-1,2,3-triol are: (1)ACD/LogP: 1.68; (2)#H bond acceptors: 3; (3)#H bond donors: 3; (4)#Freely Rotating Bonds: 11; (5)Polar Surface Area: 78.29 Å2; (6)Index of Refraction: 1.544; (7)Molar Refractivity: 73.4 cm3; (8)Molar Volume: 232.4 cm3; (9)Polarizability: 29.09x10-24cm3; (10)Surface Tension: 46.8 dyne/cm; (11)Density: 1.154 g/cm3; (12)Flash Point: 215.6 °C; (13)Enthalpy of Vaporization: 81.02 kJ/mol; (14)Boiling Point: 444.3 °C at 760 mmHg; (15)Vapour Pressure: 9.25E-10 mmHg at 25 °C.
You can still convert the following datas into molecular structure:
(1)SMILES: S(C(C)C)C(SC(C)C)CC(O)C(O)CO
(2)InChI: InChI=1/C11H24O3S2/c1-7(2)15-11(16-8(3)4)5-9(13)10(14)6-12/h7-14H,5-6H2,1-4H3
(3)InChIKey: IRUFIBUNWDMBNL-UHFFFAOYAD
(4)Std. InChI: InChI=1S/C11H24O3S2/c1-7(2)15-11(16-8(3)4)5-9(13)10(14)6-12/h7-14H,5-6H2,1-4H3
(5)Std. InChIKey: IRUFIBUNWDMBNL-UHFFFAOYSA-N