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CAS No.: | 90872-72-3 |
---|---|
Name: | 6-Methyl Nornicotine |
Article Data: | 3 |
Molecular Structure: | |
Formula: | C10H14N2 |
Molecular Weight: | 162.2316 |
Synonyms: | 2-Picoline,5-(2-pyrrolidinyl)- (7CI); |
Density: | 1.023 g/cm3 |
Melting Point: | 65-700°C |
Boiling Point: | 269.4 °C at 760 mmHg |
Flash Point: | 116.7 °C |
Appearance: | Colourless Oil |
PSA: | 24.92000 |
LogP: | 2.14330 |
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The Pyridine,2-methyl-5-(2-pyrrolidinyl)-, with CAS registry number 90872-72-3, belongs to the following product categories: (1)Heterocyclic Compounds; (2)Heterocycles; (3)Nicotine Derivatives. It has the systematic name of 2-methyl-5-pyrrolidin-2-yl-pyridine. This chemical is a kind of colourless oil. And the chemical formula of this chemical is C10H14N2.
Physical properties of Pyridine,2-methyl-5-(2-pyrrolidinyl)-: (1)ACD/LogP: 0.75; (2)# of Rule of 5 Violations: 0; (3)#H bond acceptors: 2; (4)#H bond donors: 1; (5)#Freely Rotating Bonds: 1; (6)Polar Surface Area: 24.92 Å2; (7)Index of Refraction: 1.532; (8)Molar Refractivity: 49.15 cm3; (9)Molar Volume: 158.4 cm3; (10)Polarizability: 19.48×10-24cm3; (11)Surface Tension: 39.8 dyne/cm; (12)Density: 1.023 g/cm3; (13)Flash Point: 116.7 °C; (14)Enthalpy of Vaporization: 50.75 kJ/mol; (15)Boiling Point: 269.4 °C at 760 mmHg; (16)Vapour Pressure: 0.00726 mmHg at 25°C.
Preparation: this chemical can be prepared by 5-(4,5-dihydro-1H-pyrrol-2-yl)-2-methyl-pyridine. This reaction will need reagents sodium cyanoborohydride, 2N HCl and solvent methanol. The yield is about 94%.
You can still convert the following datas into molecular structure:
(1)SMILES: Cc1ccc(cn1)C2CCCN2
(2)InChI: InChI=1/C10H14N2/c1-8-4-5-9(7-12-8)10-3-2-6-11-10/h4-5,7,10-11H,2-3,6H2,1H3
(3)InChIKey: WZVVISVPTUREQN-UHFFFAOYAJ
(4)Std. InChI: InChI=1S/C10H14N2/c1-8-4-5-9(7-12-8)10-3-2-6-11-10/h4-5,7,10-11H,2-3,6H2,1H3
(5)Std. InChIKey: WZVVISVPTUREQN-UHFFFAOYSA-N