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CAS No.: | 209526-98-7 |
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Name: | 2-Pyridinemethanol,5-chloro-(9CI) |
Article Data: | 1 |
Molecular Structure: | |
Formula: | C6H6ClNO |
Molecular Weight: | 143.573 |
Synonyms: | 2-Pyridinemethanol,5-chloro-(9CI);(5-Chloropyridin-2-yl)methanol;5-Chloropyridine-2-methanol; |
Density: | 1.324 g/cm3 |
Melting Point: | 45~47℃ |
Boiling Point: | 234.897 °C at 760 mmHg |
Flash Point: | 95.862 °C |
PSA: | 33.12000 |
LogP: | 1.22730 |
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The (5-Chloro-2-pyridinyl)methanol, with the CAS registry number 209526-98-7, is also known as 5-Chloropyridine-2-methanol. It belongs to the product category of Pyridine. This chemical's molecular formula is C6H6ClNO and molecular weight is 143.57. What's more, its systematic name is (5-Chloro-2-pyridinyl)methanol.
Physical properties of (5-Chloro-2-pyridinyl)methanol are: (1)ACD/LogP: 0.88; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 0.88; (4)ACD/LogD (pH 7.4): 0.88; (5)ACD/BCF (pH 5.5): 2.74; (6)ACD/BCF (pH 7.4): 2.75; (7)ACD/KOC (pH 5.5): 71.64; (8)ACD/KOC (pH 7.4): 71.72; (9)#H bond acceptors: 2; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 2; (12)Polar Surface Area: 33.12 Å2; (13)Index of Refraction: 1.572; (14)Molar Refractivity: 35.69 cm3; (15)Molar Volume: 108.424 cm3; (16)Polarizability: 14.149×10-24cm3; (17)Surface Tension: 51.8 dyne/cm; (18)Density: 1.324 g/cm3; (19)Flash Point: 95.862 °C; (20)Enthalpy of Vaporization: 49.845 kJ/mol; (21)Boiling Point: 234.897 °C at 760 mmHg; (22)Vapour Pressure: 0.03 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: Clc1cnc(CO)cc1
(2)Std. InChI: InChI=1S/C6H6ClNO/c7-5-1-2-6(4-9)8-3-5/h1-3,9H,4H2
(3)Std. InChIKey: JJNKKECPOPWYNY-UHFFFAOYSA-N