Basic Information | Post buying leads | Suppliers |
Name |
2'-(Dicyclohexylphosphino)acetophenone ethylene ketal |
EINECS | N/A |
CAS No. | 221187-50-4 | Density | N/A |
PSA | 32.05000 | LogP | 5.67870 |
Solubility | N/A | Melting Point |
85-92 °C |
Formula | C22H33O2P | Boiling Point | 485.365 °C at 760 mmHg |
Molecular Weight | 360.477 | Flash Point | 308.819 °C |
Transport Information | N/A | Appearance | N/A |
Safety | Risk Codes | N/A | |
Molecular Structure | Hazard Symbols | N/A | |
Synonyms |
2'-(Dicyclohexylphosphino)acetophenone ethylene ketal; |
The Phosphine, dicyclohexyl[2-(2-methyl-1, 3-dioxolan-2-yl)phenyl]-, with the CAS registry number of 221187-50-4, is also known as 2'-(Dicyclohexylphosphino)acetophenone ethylene ketal. It belongs to the product categories of Phosphine Ligandscatalysis and Inorganic Chemistry; Symphos; Catalysis and Inorganic Chemistry; Cross-Coupling; Phosphorus Compounds. This chemical's molecular formula is C22H33O2P and molecular weight is 360.48. What's more, its systematic name is Dicyclohexyl[2-(2-methyl-1, 3-dioxolan-2-yl)phenyl]phosphane.
Physical properties about Phosphine, dicyclohexyl[2-(2-methyl-1, 3-dioxolan-2-yl)phenyl]- are: (1)ACD/LogP: 6.65; (2)# of Rule of 5 Violations: 1; (3)ACD/LogD (pH 5.5): 7; (4)ACD/LogD (pH 7.4): 7; (5)ACD/BCF (pH 5.5): 65405; (6)ACD/BCF (pH 7.4): 65405; (7)ACD/KOC (pH 5.5): 97409; (8)ACD/KOC (pH 7.4): 97409; (9)#H bond acceptors: 2; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 4; (12)Polar Surface Area: 32.05 Å2; (13)Flash Point: 308.819 °C; (14)Enthalpy of Vaporization: 72.227 kJ/mol; (15)Boiling Point: 485.365 °C at 760 mmHg; (16)Vapour Pressure: 0 mmHg at 25 °C.
You can still convert the following data into molecular structure:
(1) SMILES: O1C(OCC1)(c2c(cccc2)P(C3CCCCC3)C4CCCCC4)C
(2) InChI: InChI=1/C22H33O2P/c1-22(23-16-17-24-22)20-14-8-9-15-21(20)25(18-10-4-2-5-11-18)19-12-6-3-7-13-19/h8-9,14-15,18-19H,2-7,10-13,16-17H2,1H3
(3) InChIKey: ZQASITYRQOCACA-UHFFFAOYAW