Basic Information | Post buying leads | Suppliers |
Name |
Bicyclo[2.2.2]octan-1-amine,4-phenyl- |
EINECS | N/A |
CAS No. | 10206-89-0 | Density | 1.092 g/cm3 |
PSA | 26.02000 | LogP | 3.69000 |
Solubility | N/A | Melting Point |
N/A |
Formula | C14H19N | Boiling Point | 300.7 °C at 760 mmHg |
Molecular Weight | 201.312 | Flash Point | 138.7 °C |
Transport Information | N/A | Appearance | N/A |
Safety | Risk Codes | N/A | |
Molecular Structure | Hazard Symbols | N/A | |
Synonyms |
1-Amino-4-phenylbicyclo[2.2.2]octane;4-Phenylbicyclo[2.2.2]octan-1-amine; |
The Bicyclo[2.2.2]octan-1-amine,4-phenyl-, with the CAS registry number 10206-89-0, is also known as 4-Phenylbicyclo[2.2.2]octan-1-amine. This chemical's molecular formula is C14H19N and molecular weight is 201.3074. What's more, its IUPAC name is 1-Phenylbicyclo[2.2.2]octan-4-amine.
Physical properties about Bicyclo[2.2.2]octan-1-amine,4-phenyl- are: (1)ACD/LogP: 3.30; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 0.2; (4)ACD/LogD (pH 7.4): 0.39; (5)ACD/BCF (pH 5.5): 1; (6)ACD/BCF (pH 7.4): 1; (7)ACD/KOC (pH 5.5): 1.19; (8)ACD/KOC (pH 7.4): 1.84; (9)#H bond acceptors: 1; (10)#H bond donors: 2; (11)#Freely Rotating Bonds: 2; (12)Polar Surface Area: 3.24 Å2; (13)Index of Refraction: 1.596; (14)Molar Refractivity: 62.74 cm3; (15)Molar Volume: 184.2 cm3; (16)Polarizability: 24.87×10-24 cm3; (17)Surface Tension: 53.6 dyne/cm; (18)Density: 1.092 g/cm3; (19)Flash Point: 138.7 °C; (20)Enthalpy of Vaporization: 54.08 kJ/mol; (21)Boiling Point: 300.7 °C at 760 mmHg; (22)Vapour Pressure: 0.0011 mmHg at 25 °C.
You can still convert the following datas into molecular structure:
(1) SMILES: NC23CCC(c1ccccc1)(CC2)CC3
(2) InChI: InChI=1/C14H19N/c15-14-9-6-13(7-10-14,8-11-14)12-4-2-1-3-5-12/h1-5H,6-11,15H2
(3) InChIKey: JXMVQBDHMBOHDH-UHFFFAOYAL