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CAS No.: | 67580-61-4 |
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Name: | 4-(2-DIETHYLAMINOETHYL)PYRIDINE |
Article Data: | 5 |
Molecular Structure: | |
Formula: | C11H18N2 |
Molecular Weight: | 178.277 |
Synonyms: | 4-(2-Diethylaminoethyl)pyridine; |
Density: | 0.944 g/cm3 |
Boiling Point: | 269.2 °C at 760 mmHg |
Flash Point: | 116.6 °C |
Hazard Symbols: | C |
PSA: | 16.13000 |
LogP: | 1.96590 |
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The 4-Pyridineethanamine, N, N-diethyl-, with the CAS registry number 67580-61-4, is also known as 4-(2-Diethylaminoethyl)pyridine. This chemical's molecular formula is C11H18N2 and molecular weight is 178.27. What's more, its IUPAC name is N, N-Diethyl-2-pyridin-4-ylethanamine. In addition, this chemical may destroy living tissue.
Physical properties about 4-Pyridineethanamine, N, N-diethyl- are: (1)ACD/LogP: 1.71; (2)# of Rule of 5 Violations: 0; (3)#H bond acceptors: 2; (4)#H bond donors: 0; (5)#Freely Rotating Bonds: 5; (6)Polar Surface Area: 16.13 Å2; (7)Index of Refraction: 1.506; (8)Molar Refractivity: 56.14 cm3; (9)Molar Volume: 188.7 cm3; (10)Polarizability: 22.25×10-24 cm3; (11)Surface Tension: 36.1 dyne/cm; (12)Density: 0.944 g/cm3; (13)Flash Point: 116.6 °C; (14)Enthalpy of Vaporization: 50.73 kJ/mol; (15)Boiling Point: 269.2 °C at 760 mmHg; (16)Vapour Pressure: 0.00736 mmHg at 25 °C.
Preparation of 4-Pyridineethanamine, N, N-diethyl-: this chemical is prepared by reaction of 4-Vinyl-pyridine with Diethylamine by heating. The reaction needs reagent AcOH and solvent Propan-2-ol. The reaction time is 7 days. The yield is about 53 %.
You can still convert the following datas into molecular structure:
(1) SMILES: n1ccc(cc1)CCN(CC)CC
(2) InChI: InChI=1/C11H18N2/c1-3-13(4-2)10-7-11-5-8-12-9-6-11/h5-6,8-9H,3-4,7,10H2,1-2H3
(3) InChIKey: KHPJCEUYRXYZBA-UHFFFAOYAA