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CAS No.: | 170449-34-0 |
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Name: | 2-PYRIDINESULFONYLACETONITRILE |
Molecular Structure: | |
Formula: | C7H6N2O2S |
Molecular Weight: | 182.203 |
Synonyms: | Acetonitrile, (2-pyridinylsulfonyl)- (9CI);(2-Pyridinesulfonyl)acetonitrile;(Pyridin-2-ylsulfonyl)acetonitrile; |
Density: | 1.356 g/cm3 |
Melting Point: | 77-79 °C |
Boiling Point: | 440.8 °C at 760 mmHg |
Flash Point: | 220.4 °C |
Hazard Symbols: | R20/21/22:Harmful by inhalation, in contact with skin and if swallowed.; |
Risk Codes: | 20/21/22 |
Safety: | 22-36/37 |
PSA: | 79.20000 |
LogP: | 1.45968 |
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The Acetonitrile, 2-(2-pyridinylsulfonyl)- is an organic compound with the formula C7H6N2O2S. The systematic name of this chemical is (Pyridin-2-ylsulfonyl)acetonitrile. With the CAS registry number 170449-34-0, it is also named as 2-(2-Pyridylsulfonyl)acetonitrile. Besides, it should be stored in a cool, sealed, dry, well-ventilated place.
Physical properties about Acetonitrile, 2-(2-pyridinylsulfonyl)- are: (1)ACD/LogP: -1.19; (2)ACD/LogD (pH 5.5): -1.19; (3)ACD/LogD (pH 7.4): -1.19; (4)ACD/BCF (pH 5.5): 1; (5)ACD/BCF (pH 7.4): 1; (6)ACD/KOC (pH 5.5): 5.39; (7)ACD/KOC (pH 7.4): 5.39; (8)#H bond acceptors: 4; (9)#Freely Rotating Bonds: 2; (10)Polar Surface Area: 79.2 Å2; (11)Index of Refraction: 1.546; (12)Molar Refractivity: 42.57 cm3; (13)Molar Volume: 134.3 cm3; (14)Polarizability: 16.87×10-24 cm3; (15)Surface Tension: 56.5 dyne/cm; (16)Density: 1.356 g/cm3; (17)Flash Point: 220.4 °C; (18)Enthalpy of Vaporization: 69.8 kJ/mol; (19)Boiling Point: 440.8 °C at 760 mmHg; (20)Vapour Pressure: 5.72E-08 mmHg at 25 °C.
When you are using this chemical, please be cautious about it as the following:
It is harmful by inhalation, in contact with skin and if swallowed. When you are using it, do not breathe dust and wear suitable protective clothing and gloves.
You can still convert the following datas into molecular structure:
(1)InChI: InChI=1/C7H6N2O2S/c8-4-6-12(10,11)7-3-1-2-5-9-7/h1-3,5H,6H2
(2)InChIKey: SAKACXZDAJXBCI-UHFFFAOYAP
(3)Std. InChI: InChI=1S/C7H6N2O2S/c8-4-6-12(10,11)7-3-1-2-5-9-7/h1-3,5H,6H2
(4)Std. InChIKey: SAKACXZDAJXBCI-UHFFFAOYSA-N