Basic Information | Post buying leads | Suppliers | Cas Database |
Name |
Guaiacylglycerol |
EINECS | N/A |
CAS No. | 1208-42-0 | Density | 1.383 g/cm3 |
PSA | N/A | LogP | N/A |
Solubility | N/A | Melting Point |
N/A |
Formula | C10H14O5 | Boiling Point | 483.7 °C at 760 mmHg |
Molecular Weight | 214.218 | Flash Point | 246.3 °C |
Transport Information | N/A | Appearance | N/A |
Safety | Risk Codes | N/A | |
Molecular Structure | Hazard Symbols | N/A | |
Synonyms |
a-Guaiacylglycerol;1-(4-Hydroxy-3-methoxyphenyl)glycerol;1-Guaiacylglycerol;1-(4-Hydroxy-3-methoxyphenyl)propane-1,2,3-triol; |
Article Data | 6 |
The CAS registry number of 1,2,3-Propanetriol,1-(4-hydroxy-3-methoxyphenyl)- is 1208-42-0. Its systematic name is 1-(4-hydroxy-3-methoxyphenyl)propane-1,2,3-triol. In addition, the molecular formula is C10H14O5 and the molecular weight is 214.08. What's more, it should be stored in sealed container, and put in a cool and dry place.
Physical properties about 1,2,3-Propanetriol,1-(4-hydroxy-3-methoxyphenyl)- are: (1)ACD/LogP: -1.48; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): -1.48; (4)ACD/LogD (pH 7.4): -1.49; (5)ACD/BCF (pH 5.5): 1; (6)ACD/BCF (pH 7.4): 1; (7)ACD/KOC (pH 5.5): 3.71; (8)ACD/KOC (pH 7.4): 3.7; (9)#H bond acceptors: 5; (10)#H bond donors: 4; (11)#Freely Rotating Bonds: 8; (12)Polar Surface Area: 46.15 Å2; (13)Index of Refraction: 1.608; (14)Molar Refractivity: 53.56 cm3; (15)Molar Volume: 154.8 cm3; (16)Polarizability: 21.23 ×10-24cm3; (17)Surface Tension: 66.1 dyne/cm; (18)Density: 1.383 g/cm3; (19)Flash Point: 246.3 °C; (20)Enthalpy of Vaporization: 78.88 kJ/mol; (21)Boiling Point: 483.7 °C at 760 mmHg; (22)Vapour Pressure: 3.62E-10 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: Oc1ccc(cc1OC)C(O)C(O)CO
(2)Std. InChI: InChI=1S/C10H14O5/c1-15-9-4-6(2-3-7(9)12)10(14)8(13)5-11/h2-4,8,10-14H,5H2,1H3
(3)Std. InChIKey: LSKFUSLVUZISST-UHFFFAOYSA-N