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Name
N,N-DIETHYL-N-[2-(2-PYRIDYL)ETHYL]AMINE
- EINECS 247-309-9
- CAS No. 25877-30-9
- Article Data13
- CAS DataBase
- Density 0.944 g/cm3
- Solubility
- Melting Point
- Formula C11H18N2
- Boiling Point 253.6 °C at 760 mmHg
- Molecular Weight 178.277
- Flash Point 107.1 °C
- Transport Information
- Appearance
- Safety
- Risk Codes
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Molecular Structure
- Hazard Symbols Xi
- Synonyms Pyridine,2-[2-(diethylamino)ethyl]- (6CI,7CI);2-(2-Diethylaminoethyl)pyridine;2-[(Diethylamino)ethyl]pyridine;N,N-Diethyl-2-pyridineethylamine;NSC 76607;
- PSA 16.13000
- LogP 1.96590
2-Pyridineethanamine,N,N-diethyl- Specification
The 2-Pyridineethanamine,N,N-diethyl- is an organic compound with the formula C11H18N2. The IUPAC name of this chemical is N,N-Diethyl-2-pyridin-2-ylethanamine. With the CAS registry number 25877-30-9, it is also named as 2-(2-Diethylaminoethyl)pyridine. Besides, its molecular weight is 178.27.
The physical properties of 2-Pyridineethanamine,N,N-diethyl- are: (1)ACD/LogP: 1.71; (2)ACD/LogD (pH 5.5): -1.43; (3)ACD/LogD (pH 7.4): -0.68; (4)ACD/BCF (pH 5.5): 1; (5)ACD/BCF (pH 7.4): 1; (6)ACD/KOC (pH 5.5): 1; (7)ACD/KOC (pH 7.4): 1; (8)#H bond acceptors: 2; (9)#Freely Rotating Bonds: 5; (10)Polar Surface Area: 16.13 Å2; (11)Index of Refraction: 1.506; (12)Molar Refractivity: 56.14 cm3; (13)Molar Volume: 188.7 cm3; (14)Polarizability: 22.25×10-24 cm3; (15)Surface Tension: 36.1 dyne/cm; (16)Density: 0.944 g/cm3; (17)Flash Point: 107.1 °C; (18)Enthalpy of Vaporization: 49.1 kJ/mol; (19)Boiling Point: 253.6 °C at 760 mmHg; (20)Vapour Pressure: 0.0181 mmHg at 25 °C.
Preparation: this chemical can be prepared by Diethylamine and 2-Vinyl-pyridine. This reaction will need reagent Bu3SnH, catalyst AIBN and solvent benzene. The reaction time is 90 min with reaction temperature of 80 °C. The yield is about 78%.
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You can still convert the following datas into molecular structure:
(1)SMILES: n1ccccc1CCN(CC)CC
(2)InChI: InChI=1/C11H18N2/c1-3-13(4-2)10-8-11-7-5-6-9-12-11/h5-7,9H,3-4,8,10H2,1-2H3
(3)InChIKey: PMDWLPBLYZHLHW-UHFFFAOYAH
(4)Std. InChI: InChI=1S/C11H18N2/c1-3-13(4-2)10-8-11-7-5-6-9-12-11/h5-7,9H,3-4,8,10H2,1-2H3
(5)Std. InChIKey: PMDWLPBLYZHLHW-UHFFFAOYSA-N
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