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CAS No.: | 6310-56-1 |
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Name: | 4-[(4-dimethylaminophenyl)-(4-propan-2-ylphenyl)methyl]-N,N-dimethyl-a niline |
Molecular Structure: | |
Formula: | C26H32N2 |
Molecular Weight: | 372.553 |
Synonyms: | NSC 43918;Aniline,4,4'-(p-isopropylbenzylidene)bis[N,N-dimethyl- (8CI); |
Density: | 1.038 g/cm3 |
Boiling Point: | 505.3 °C at 760 mmHg |
Flash Point: | 226.7 °C |
PSA: | 6.48000 |
LogP: | 6.12220 |
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The 4, 4'-{[4-(Propan-2-yl)phenyl]methanediyl}bis(N, N-dimethylaniline), with the CAS registry number 6310-56-1, is also known as Aniline, 4, 4'-(p-isopropylbenzylidene)bis[N, N-dimethyl- (8CI). This chemical's molecular formula is C26H32N2 and molecular weight is 372.5457. What's more, its IUPAC name is 4-[[4-(Dimethylamino)phenyl]-(4-propan-2-ylphenyl)methyl]-N, N-dimethylaniline.
Physical properties about 4, 4'-{[4-(Propan-2-yl)phenyl]methanediyl}bis(N, N-dimethylaniline) are: (1)ACD/LogP: 7.25; (2)# of Rule of 5 Violations: 1; (3)#H bond acceptors: 2; (4)#H bond donors: 0; (5)#Freely Rotating Bonds: 6; (6)Polar Surface Area: 6.48 Å2; (7)Index of Refraction: 1.6; (8)Molar Refractivity: 122.78 cm3; (9)Molar Volume: 358.7 cm3; (10)Polarizability: 48.67×10-24 cm3; (11)Surface Tension: 41.4 dyne/cm; (12)Density: 1.038 g/cm3; (13)Flash Point: 226.7 °C; (14)Enthalpy of Vaporization: 77.5 kJ/mol; (15)Boiling Point: 505.3 °C at 760 mmHg; (16)Vapour Pressure: 2.46E-10 mmHg at 25 °C.
You can still convert the following datas into molecular structure:
(1) SMILES: N(c1ccc(cc1)C(c2ccc(cc2)C(C)C)c3ccc(N(C)C)cc3)(C)C
(2) InChI: InChI=1/C26H32N2/c1-19(2)20-7-9-21(10-8-20)26(22-11-15-24(16-12-22)27(3)4)23-13-17-25(18-14-23)28(5)6/h7-19,26H,1-6H3
(3) InChIKey: ONEBQAIIFZDIJC-UHFFFAOYAV