Basic Information | Post buying leads | Suppliers |
Name |
Propane-1,1,1,2,3,3-d6,2,3-dibromo- (9CI) |
EINECS | N/A |
CAS No. | 51209-47-3 | Density | 1.984 g/cm3 |
PSA | 0.00000 | LogP | 2.16470 |
Solubility | N/A | Melting Point |
N/A |
Formula | C3Br2D6 | Boiling Point | 140.374 °C at 760 mmHg |
Molecular Weight | 207.92 | Flash Point | 21.907 °C |
Transport Information | N/A | Appearance | N/A |
Safety | Risk Codes | N/A | |
Molecular Structure | Hazard Symbols | N/A | |
Synonyms |
1,2-Dibromopropane-d6;Propane-1,1,1,2,3,3-d,2,3-dibromo- (6CI); |
The CAS registry number of Propane-1,1,1,2,3,3-d6,2,3-dibromo- (9CI) is 51209-47-3. This chemical is also named as 1,2-Dibromopropane-d6. In addition, its molecular formula is C3Br2D6 and molecular weight is 207.92. Its systematic name is called 1,2-Dibromo(2H6)propane.
Physical properties about Propane-1,1,1,2,3,3-d6,2,3-dibromo- (9CI) are: (1)ACD/LogP: 2.38; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 2.378; (4)ACD/LogD (pH 7.4): 2.378; (5)ACD/BCF (pH 5.5): 37.785; (6)ACD/BCF (pH 7.4): 37.785; (7)ACD/KOC (pH 5.5): 468.45; (8)ACD/KOC (pH 7.4): 468.45; (9)#H bond acceptors: 0; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 1; (12)Index of Refraction: 1.511; (13)Molar Refractivity: 31.37 cm3; (14)Molar Volume: 104.796 cm3; (15)Surface Tension: 34.062 dyne/cm; (16)Density: 1.984 g/cm3; (17)Flash Point: 21.907 °C; (18)Enthalpy of Vaporization: 35.61 kJ/mol; (19)Boiling Point: 140.374 °C at 760 mmHg; (20)Vapour Pressure: 7.679 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: [2H]C([2H])([2H])C([2H])(C([2H])([2H])Br)Br
(2)InChI: InChI=1/C3H6Br2/c1-3(5)2-4/h3H,2H2,1H3/i1D3,2D2,3D
(3)InChIKey: XFNJYAKDBJUJAJ-LIDOUZCJES