Basic Information | Post buying leads | Suppliers |
Name |
17beta-Dihydroequilin-16,16,17-d3 |
EINECS | N/A |
CAS No. | 350820-03-0 | Density | 1.243 g/cm3 |
PSA | 40.46000 | LogP | 3.73620 |
Solubility | N/A | Melting Point |
173-1750 °C |
Formula | C18H19D3O2 | Boiling Point | 457.798 °C at 760 mmHg |
Molecular Weight | 271.37 | Flash Point | 217.155 °C |
Transport Information | N/A | Appearance | tan solid solid |
Safety | Risk Codes | N/A | |
Molecular Structure | Hazard Symbols | N/A | |
Synonyms |
17BETA-DIHYDROEQUILIN-16,16,17-D3;(17b)-Estra-1,3,5(10)-7-tetraene-3,17-diol-d3;17b-Dihydroequilin-16,16,17-d3;17β-Dihydroequilin-16,16,17-D3;(17)-Estra-1,3,5(10)-7-tetraene-3,17-diol-d3;17-Dihydroequilin-d3 |
This chemical is called 17beta-Dihydroequilin-16,16,17-d3, and it's also named as (17)-Estra-1,3,5(10)-7-tetraene-3,17-diol-d3. With the molecular formula of C18H19D3O2, its molecular weight is 271.37. The CAS registry number of this chemical is 350820-03-0. Additionally, its product categories are Isotope Labeled Compounds; Steroids.
Other characteristics of the 17beta-Dihydroequilin-16,16,17-d3, and it's also named as (17)-Estra-1,3,5(10)-7-tetraene-3,17-diol-d3 can be summarised as followings: (1)ACD/LogP: 3.79; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 3.787; (4)ACD/LogD (pH 7.4): 3.786; (5)ACD/BCF (pH 5.5): 444.397; (6)ACD/BCF (pH 7.4): 443.635; (7)ACD/KOC (pH 5.5): 2734.487; (8)ACD/KOC (pH 7.4): 2729.795; (9)#H bond acceptors: 2; (10)#H bond donors: 2; (11)#Freely Rotating Bonds: 2; (12)Polar Surface Area: 40.46 Å2; (13)Index of Refraction: 1.637; (14)Molar Refractivity: 78.872 cm3; (15)Molar Volume: 219.854 cm3; (16)Polarizability: 31.267×10-24cm3; (17)Surface Tension: 55.647 dyne/cm; (18)Density: 1.243 g/cm3; (19)Flash Point: 217.155 °C; (20)Enthalpy of Vaporization: 75.655 kJ/mol; (21)Boiling Point: 457.798 °C at 760 mmHg; (22)Vapour Pressure: 0 mmHg at 25°C.
You can still convert the following datas into molecular structure:
1.SMILES: [2H][C@]1([C@]2(CCC3c4ccc(cc4CC=C3C2CC1([2H])[2H])O)C)O
2.InChI: InChI=1/C18H22O2/c1-18-9-8-14-13-5-3-12(19)10-11(13)2-4-15(14)16(18)6-7-17(18)20/h3-5,10,14,16-17,19-20H,2,6-9H2,1H3/t14?,16?,17-,18-/m0/s1/i7D2,17D
3.InChIKey: NLLMJANWPUQQTA-SCHMTDERFN