Basic Information | Post buying leads | Suppliers | Cas Database |
Name |
1-Propene-3,3,3-d3 |
EINECS | N/A |
CAS No. | 1517-51-7 | Density | 0.617 g/cm3 |
PSA | 0.00000 | LogP | 1.19230 |
Solubility | N/A | Melting Point |
N/A |
Formula | C3H3D3 | Boiling Point | N/A |
Molecular Weight | 45.0568 | Flash Point | N/A |
Transport Information | N/A | Appearance | N/A |
Safety | Risk Codes | N/A | |
Molecular Structure | Hazard Symbols | N/A | |
Synonyms |
Propene-3,3,3-d3(6CI,7CI,8CI);3,3,3-Trideuterio-1-propene;3,3,3-Trideuteriopropene;3,3,3-Trideuteropropene; |
Article Data | 1 |
This chemical is called 1-Propene-3,3,3-d3, and its systematic name is (3,3,3-2H3)Prop-1-ene. With the molecular formula of C3H3D3, its molecular weight is 45.10. The CAS registry number of this chemical is 1517-51-7.
Other characteristics of the 1-Propene-3,3,3-d3 can be summarised as followings: (1)ACD/LogP: 1.83; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 1.827; (4)ACD/LogD (pH 7.4): 1.827; (5)ACD/BCF (pH 5.5): 14.411; (6)ACD/BCF (pH 7.4): 14.411; (7)ACD/KOC (pH 5.5): 234.973; (8)ACD/KOC (pH 7.4): 234.973; (9)#H bond acceptors: 0; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 0; (12)Index of Refraction: 1.348; (13)Molar Refractivity: 15.673 cm3; (14)Molar Volume: 73.149 cm3; (15)Polarizability: 6.213×10-24cm3; (16)Surface Tension: 13.615 dyne/cm; (17)Density: 0.617 g/cm3; (18)Flash Point: °C; (19)Enthalpy of Vaporization: 18.42 kJ/mol; (20)Boiling Point: °C at 760 mmHg Vapour; (21)Pressure: 8476.793 mmHg at 25°C.
You can still convert the following datas into molecular structure:
1.SMILES: [2H]C([2H])([2H])C=C
2.InChI: InChI=1/C3H6/c1-3-2/h3H,1H2,2H3/i2D3
3.InChIKey: QQONPFPTGQHPMA-BMSJAHLVEN