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7325-16-8

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Basic Information
CAS No.: 7325-16-8
Name: GLYCEROL-(OD)3
Article Data: 3
Molecular Structure:
Molecular Structure of 7325-16-8 (GLYCEROL-(OD)3)
Formula: C3H5D3O3
Molecular Weight: 95.0709
Synonyms: Glycerol-O,O,O-d3(8CI);Glycerine-d3;Glycerol-d3;
Density: 1.34 g/cm3
Melting Point: 20 °C(lit.)
Boiling Point: 290 °C at 760 mmHg
Flash Point: 160 °C
PSA: 60.69000
LogP: -1.66810
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Specification

The 1,2,3-Propanetriol-d3(9CI) is an organic compound with the formula C3H5D3O3. The systematic name of this chemical is propane-1,2,3-(2H3)triol. With the CAS registry number 7325-16-8, it is also named as Glycer(ol-d3). The product's categories are Alphabetical Listings; Fatty AcidsStable Isotopes; G-H; Metabolic Research; Stable Isotopes.

Physical properties about 1,2,3-Propanetriol-d3(9CI) are: (1)ACD/BCF (pH 5.5): 1; (2)ACD/BCF (pH 7.4): 1; (3)ACD/KOC (pH 5.5): 1.3; (4)ACD/KOC (pH 7.4): 1.3; (5)#H bond acceptors: 3; (6)#H bond donors: 3; (7)#Freely Rotating Bonds: 5; (8)Polar Surface Area: 27.69 Å2; (9)Index of Refraction: 1.489; (10)Molar Refractivity: 20.51 cm3; (11)Molar Volume: 70.9 cm3; (12)Polarizability: 8.13×10-24cm3; (13)Surface Tension: 61.9 dyne/cm; (14)Density: 1.34 g/cm3; (15)Flash Point: 160 °C; (16)Enthalpy of Vaporization: 61.42 kJ/mol; (17)Boiling Point: 290 °C at 760 mmHg; (18)Vapour Pressure: 0.000232 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: [2H]OCC(O[2H])CO[2H]
(2)InChI: InChI=1/C3H8O3/c4-1-3(6)2-5/h3-6H,1-2H2/i4D,5D,6D
(3)InChIKey: PEDCQBHIVMGVHV-WVALGTIDEJ
(4)Std. InChI: InChI=1S/C3H8O3/c4-1-3(6)2-5/h3-6H,1-2H2/i4D,5D,6D
(5)Std. InChIKey: PEDCQBHIVMGVHV-WVALGTIDSA-N