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CAS No.: | 143071-39-0 |
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Name: | 2-[(5-NITRO-2-PYRIDYL)OXY]ETHAN-1-OL |
Molecular Structure: | |
Formula: | C7H8N2O4 |
Molecular Weight: | 184.152 |
Synonyms: | 2-(2-Hydroxyethoxy)-5-nitropyridine;2-[(5-Nitro-2-pyridyl)oxy]ethanol;2-[(5-Nitropyridin-2-yl)oxy]ethanol; |
EINECS: | -0 |
Density: | 1.389 g/cm3 |
Melting Point: | 112-114°C |
Boiling Point: | 355.695 °C at 760 mmHg |
Flash Point: | 168.918 °C |
Appearance: | colorless or light yellow liquid |
Safety: | 22-24/25 |
PSA: | 88.17000 |
LogP: | 0.88410 |
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This chemical is called Ethanol, 2-[(5-nitro-2-pyridinyl)oxy]-, and its systematic name is 2-[(5-nitropyridin-2-yl)oxy]ethanol. With the molecular formula of C7H8N2O4, its molecular weight is 184.15. The CAS registry number of this chemical is 143071-39-0. In addition, this chemical should be sealed in the cool and dry place.
Other characteristics of the Ethanol, 2-[(5-nitro-2-pyridinyl)oxy]- can be summarised as followings: (1)ACD/LogP: 0.78; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 0.778; (4)ACD/LogD (pH 7.4): 0.778; (5)ACD/BCF (pH 5.5): 2.297; (6)ACD/BCF (pH 7.4): 2.297; (7)ACD/KOC (pH 5.5): 63.126; (8)ACD/KOC (pH 7.4): 63.126; (9)#H bond acceptors: 6; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 5; (12)Polar Surface Area: 88.17 Å2; (13)Index of Refraction: 1.574; (14)Molar Refractivity: 43.736 cm3; (15)Molar Volume: 132.514 cm3; (16)Polarizability: 17.338×10-24cm3; (17)Surface Tension: 60.84 dyne/cm; (18)Density: 1.39 g/cm3; (19)Flash Point: 168.918 °C; (20)Enthalpy of Vaporization: 63.404 kJ/mol; (21)Boiling Point: 355.695 °C at 760 mmHg; (22)Vapour Pressure: 0 mmHg at 25°C.
When you are using this chemical, please be cautious about it as the following: Do not breathe dust. Avoid contacting with skin and eyes.
You can still convert the following datas into molecular structure:
1.SMILES: c1cc(ncc1N(=O)=O)OCCO
2.InChI: InChI=1/C7H8N2O4/c10-3-4-13-7-2-1-6(5-8-7)9(11)12/h1-2,5,10H,3-4H2
3.InChIKey: KESQFSZFUCZCEI-UHFFFAOYAP