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CAS No.: | 52605-96-6 |
---|---|
Name: | 2-Chloro-3-methoxypyridine |
Article Data: | 16 |
Molecular Structure: | |
Formula: | C6H6ClNO |
Molecular Weight: | 143.573 |
Synonyms: | 3-methoxy-2-chloropyridine;2-Chloro-3-Methoxypyridine;2-chloro-3-methoxy-pyridine;2-Chlor-3-methoxy-pyridin;2-chlor-3-methoxypyridine;Pyridine,2-chloro-3-methoxy; |
EINECS: | 258-039-6 |
Density: | 1.21 g/cm3 |
Melting Point: | 90-92 °C |
Boiling Point: | 210.6 °C at 760 mmHg |
Flash Point: | 81.2 °C |
Solubility: | Insoluble in water. |
Appearance: | crystalline powder |
Hazard Symbols: | R36/37/38:Irritating to eyes, respiratory system and skin.; |
Risk Codes: | 36/37/38 |
Safety: | 26-36/37/39 |
PSA: | 22.12000 |
LogP: | 1.74360 |
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This chemical has the IUPAC name 2-Chloro-3-methoxypyridine, and it's also named as Pyridine, 2-chloro-3-methoxy-. With the CAS registry number 52605-96-6, its molecular formula is C6H6ClNO. However, this chemical whose category is Pyridine should be sealed in the cool and dry place where the room is ventilated.
Other characteristics of the 2-Chloro-3-methoxypyridine can be summarised as followings: (1)ACD/LogP: 1.70; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 1.7; (4)ACD/LogD (pH 7.4): 1.7; (5)ACD/BCF (pH 5.5): 11.46; (6)ACD/BCF (pH 7.4): 11.46; (7)ACD/KOC (pH 5.5): 199.47; (8)ACD/KOC (pH 7.4): 199.47; (9)#H bond acceptors: 2; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 1; (12)Polar Surface Area: 22.12 Å2; (13)Index of Refraction: 1.517; (14)Molar Refractivity: 35.91 cm3; (15)Molar Volume: 118.6 cm3; (16)Polarizability: 14.23×10-24cm3; (17)Surface Tension: 37.7 dyne/cm; (18)Density: 1.21 g/cm3; (19)Flash Point: 81.2 °C; (20)Enthalpy of Vaporization: 42.87 kJ/mol; (21)Boiling Point: 210.6 °C at 760 mmHg; (22)Vapour Pressure: 0.276 mmHg at 25°C.
When you are using this chemical, please be cautious about it as the following: This chemical is irritating to eyes, respiratory system and skin. You should wear suitable protective clothing if you use it. In case of contacting with eyes, rinse immediately with plenty of water and seek medical advice.
You can still convert the following datas into molecular structure:
1.SMILES: Clc1ncccc1OC
2.InChI: InChI=1/C6H6ClNO/c1-9-5-3-2-4-8-6(5)7/h2-4H,1H3
3.InChIKey: CCVNZKGBNUPYPG-UHFFFAOYAS