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CAS No.: | 4673-31-8 |
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Name: | 3-PROPYLPYRIDINE |
Article Data: | 19 |
Molecular Structure: | |
Formula: | C8H11N |
Molecular Weight: | 121.182 |
Synonyms: | 3-Propylpyridine; |
EINECS: | 225-122-3 |
Density: | 0.918 g/cm3 |
Boiling Point: | 186.7 °C at 760 mmHg |
Flash Point: | 64.7 °C |
PSA: | 12.89000 |
LogP: | 2.03410 |
The Pyridine, 3-propyl-, with the CAS registry number 4673-31-8, is also known as ZINC00967178. Its EINECS registry number is 225-122-3. This chemical's molecular formula is C8H11N and molecular weight is 121.18. Its IUPAC name is called 3-propylpyridine.
Physical properties of Pyridine, 3-propyl-: (1)ACD/LogP: 2.25; (2)ACD/LogD (pH 5.5): 1.92; (3)ACD/LogD (pH 7.4): 2.24; (4)ACD/BCF (pH 5.5): 14.08; (5)ACD/BCF (pH 7.4): 29.71; (6)ACD/KOC (pH 5.5): 186.12; (7)ACD/KOC (pH 7.4): 392.8; (8)#H bond acceptors: 1; (9)#Freely Rotating Bonds: 2; (10)Index of Refraction: 1.495; (11)Molar Refractivity: 38.52 cm3; (12)Molar Volume: 131.9 cm3; (13)Surface Tension: 33.6 dyne/cm; (14)Density: 0.918 g/cm3; (15)Flash Point: 64.7 °C; (16)Enthalpy of Vaporization: 40.56 kJ/mol; (17)Boiling Point: 186.7 °C at 760 mmHg; (18)Vapour Pressure: 0.901 mmHg at 25°C.
Preparation of Pyridine, 3-propyl-: this chemical can be prepared by 1-pyridin-3-yl-propan-1-on. This reaction will need reagents KOH, hydrazine hydrate and solvent bis-(2-hydroxy-ethyl) ether. The reaction time is 4 hours. The yield is about 32%.
Uses of Pyridine, 3-propyl-: it can be used to produce (R)-1-(3'-pyridyl)-propanol. This reaction will need reagents Pseudomonas putida UV4 and O2. The yield is about 70%.
You can still convert the following datas into molecular structure:
(1)Canonical SMILES: CCCC1=CN=CC=C1
(2)InChI: InChI=1S/C8H11N/c1-2-4-8-5-3-6-9-7-8/h3,5-7H,2,4H2,1H3
(3)InChIKey: MLAXEZHEGARMPE-UHFFFAOYSA-N