Basic Information | Post buying leads | Suppliers | Cas Database |
Name |
(R)-2-(Hydroxymethyl)-1,4-benzodioxane |
EINECS | N/A |
CAS No. | 62501-72-8 | Density | 1.213±0.06 g/cm3(Predicted) |
PSA | 38.69000 | LogP | 0.81870 |
Solubility | N/A | Melting Point |
1.213 g/cm3 |
Formula | C9H10O3 | Boiling Point | 281.1 °C at 760 mmHg |
Molecular Weight | 166.17 | Flash Point | 123.8 °C |
Transport Information | N/A | Appearance | N/A |
Safety | Risk Codes | N/A | |
Molecular Structure | Hazard Symbols | N/A | |
Synonyms |
1,4-Benzodioxin-2-methanol,2,3-dihydro-, (R)-;(2R)-2-Hydroxymethyl-1,4-benzodioxan;(2R)-2-Hydroxymethyl-1,4-benzodioxane;(R)-2,3-Dihydro-1,4-benzodioxin-2-methanol;(R)-2-Hydroxymethyl-2,3-dihydro-1,4-benzodioxin; |
Article Data | 22 |
The cas register number of (R)-2-(Hydroxymethyl)-1,4-benzodioxane is 62501-72-8. It also can be called as 1,4-Benzodioxin-2-methanol,2,3-dihydro-, (2R)- and the Systematic name about this chemical is (2R)-2,3-dihydro-1,4-benzodioxin-2-ylmethanol.
Physical properties about (R)-2-(Hydroxymethyl)-1,4-benzodioxane are: (1)ACD/LogP: 0.86; (2)ACD/LogD (pH 5.5): 0.86; (3)ACD/LogD (pH 7.4): 0.86; (4)ACD/BCF (pH 5.5): 2.66; (5)ACD/BCF (pH 7.4): 2.66; (6)ACD/KOC (pH 5.5): 70.11; (7)ACD/KOC (pH 7.4): 70.11; (8)#H bond acceptors: 3; (9)#H bond donors: 1; (10)#Freely Rotating Bonds: 2; (11)Polar Surface Area: 27.69Å2; (12)Index of Refraction: 1.544; (13)Molar Refractivity: 43.25 cm3; (14)Molar Volume: 136.9 cm3; (15)Polarizability: 17.14x10-24cm3; (16)Surface Tension: 49.8 dyne/cm; (17)Enthalpy of Vaporization: 54.92 kJ/mol; (18)Vapour Pressure: 0.00172 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: O1c2c(O[C@@H](C1)CO)cccc2
(2)InChI: InChI=1/C9H10O3/c10-5-7-6-11-8-3-1-2-4-9(8)12-7/h1-4,7,10H,5-6H2/t7-/m1/s1
(3)InChIKey: GWQOQQVKVOOHTI-SSDOTTSWBZ
(4)Std. InChI: InChI=1S/C9H10O3/c10-5-7-6-11-8-3-1-2-4-9(8)12-7/h1-4,7,10H,5-6H2/t7-/m1/s1
(5)Std. InChIKey: GWQOQQVKVOOHTI-SSDOTTSWSA-N