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828918-24-7

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Basic Information
CAS No.: 828918-24-7
Name: 2,6-Bis[(4R)-4,5-dihydro-4-(1-methylethyl)-5,5-diphenyl-2-oxazolyl]pyridine
Article Data: 5
Molecular Structure:
Molecular Structure of 828918-24-7 (2,6-Bis[(4R)-4,5-dihydro-4-(1-methylethyl)-5,5-diphenyl-2-oxazolyl]pyridine)
Formula: C41H39N3O2
Molecular Weight: 605.78
Synonyms: 2,6-Bis[(4R)-4,5-dihydro-4-(1-methylethyl)-5,5-diphenyl-2-oxazolyl]pyridine;
Density: 1.15 g/cm3
Boiling Point: 739.3 °C at 760 mmHg
Flash Point: 400.9 °C
Risk Codes: 36/37/38
Safety: 26-36
PSA: 56.07000
LogP: 7.44320
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Specification

The 2,6-Bis[(4R)-4,5-dihydro-4-(1-methylethyl)-5,5-diphenyl-2-oxazolyl]pyridine with the CAS number 828918-24-7 is also called Pyridine, 2,6-bis[(4R)-4,5-dihydro-4-(1-methylethyl)-5,5-diphenyl-2-oxazolyl]-. Its molecular formula is C41H39N3O2. This chemical is a kind of organics. It should be stored in dry and cool environment.

The properties of the 2,6-Bis[(4R)-4,5-dihydro-4-(1-methylethyl)-5,5-diphenyl-2-oxazolyl]pyridine are: (1)ACD/LogP: 9.45; (2)# of Rule of 5 Violations: 2; (3)ACD/LogD (pH 5.5): 9.45; (4)ACD/LogD (pH 7.4): 9.45; (5)ACD/BCF (pH 5.5): 1000000; (6)ACD/BCF (pH 7.4): 1000000; (7)ACD/KOC (pH 5.5): 3275074; (8)ACD/KOC (pH 7.4): 3280832.5; (9)#H bond acceptors: 5; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 8; (12)Polar Surface Area: 56.07 Å2; (13)Index of Refraction: 1.624; (14)Molar Refractivity: 185.93 cm3; (15)Molar Volume: 526 cm3; (16)Polarizability: 73.7×10-24cm3; (17)Surface Tension: 43.5 dyne/cm; (18)Enthalpy of Vaporization: 104.02 kJ/mol; (19)Vapour Pressure: 7.62×10-21 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: N\3=C(\OC(c1ccccc1)(c2ccccc2)[C@H]/3C(C)C)c7nc(C/4=N/[C@H](C(C)C)C(O\4)(c5ccccc5)c6ccccc6)ccc7
(2)InChI: InChI=1/C41H39N3O2/c1-28(2)36-40(30-18-9-5-10-19-30,31-20-11-6-12-21-31)45-38(43-36)34-26-17-27-35(42-34)39-44-37(29(3)4)41(46-39,32-22-13-7-14-23-32)33-24-15-8-16-25-33/h5-29,36-37H,1-4H3/t36-,37-/m1/s1
(3)InChIKey: VUJKULRKYWRJLV-FZNHDDJXBS