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| CAS No.: | 3000-75-7 |
|---|---|
| Name: | N-(Pyridin-3-ylmethyl)ethylamine |
| Molecular Structure: | |
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| Formula: | C8H12N2 |
| Molecular Weight: | 136.197 |
| Synonyms: | N-Ethyl-N-(3-pyridylmethyl)amine;N-Ethyl-3-pyridinemethylamine; |
| Density: | 0.967 g/cm3 |
| Boiling Point: | 217.545 °C at 760 mmHg |
| Flash Point: | 85.368 °C |
| PSA: | 24.92000 |
| LogP: | 1.58200 |
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Specification
The N-(Pyridin-3-ylmethyl)ethylamine, with the CAS registry number 3000-75-7, is also known as Ethyl(pyridin-3-ylmethyl)amine. This chemical's molecular formula is C8H12N2 and molecular weight is 136.19. What's more, its systematic name is called N-(3-Pyridinylmethyl)ethanamine. It should be stored in a cool, dry and well-ventilated place. This chemical can be used as chemical reagent.
Physical properties about N-(Pyridin-3-ylmethyl)ethylamine are: (1)ACD/LogP: 0.558; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): -2.37; (4)ACD/LogD (pH 7.4): -0.93; (5)ACD/BCF (pH 5.5): 1.00; (6)ACD/BCF (pH 7.4): 1.00; (7)ACD/KOC (pH 5.5): 1.00; (8)ACD/KOC (pH 7.4): 1.56; (9)#H bond acceptors: 2; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 3; (12)Polar Surface Area: 24.92 Å2; (13)Index of Refraction: 1.51; (14)Molar Refractivity: 42.121 cm3; (15)Molar Volume: 140.797 cm3; (16)Polarizability: 16.698×10-24cm3; (17)Surface Tension: 36.369 dyne/cm; (18)Density: 0.967 g/cm3; (19)Flash Point: 85.368 °C; (20)Enthalpy of Vaporization: 45.392 kJ/mol; (21)Boiling Point: 217.545 °C at 760 mmHg; (22)Vapour Pressure: 0.132 mmHg at 25 °C.
When you are dealing with this chemical, you should be very careful. This chemical may cause inflammation to the skin, eyes and respiratory system or other mucous membranes. Therefore, you should wear suitable protective clothing, gloves and eye/face protection. In case of contacting with eyes, you should rinse immediately with plenty of water and seek medical advice.
You can still convert the following datas into molecular structure:
(1) SMILES: n1cccc(c1)CNCC
(2) InChI: InChI=1S/C8H12N2/c1-2-9-6-8-4-3-5-10-7-8/h3-5,7,9H,2,6H2,1H3
(3) InChIKey: SGROJTFSHJVVSF-UHFFFAOYSA-N