Acrylonitrile
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Acrylonitrile
structure -
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CAS No:
107-13-1
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Formula:
C3H3N
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Chemical Name:
Acrylonitrile
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Synonyms:
2-Propenenitrile;Acrylonitrile;Acrylon;Carbacryl;Cyanoethylene;Fumigrain;Propenenitrile;VCN;Vinyl cyanide;Ventox;Cyanoethene;NSC 6362;29754-21-0;63908-52-1;769126-92-3;769134-66-9;1006710-56-0;1197872-06-2;1221168-60-0;1309882-90-3;1538611-90-3;2015239-29-7
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CAS No:
Description
Colorless to pale-yellow liquid with an unpleasant odor. [Note: Odor can only be detected above the PEL.]
Acrylonitrile is an organic compound with the formula CH2CHCN. It is a colorless volatile liquid, although commercial samples can be yellow due to impurities. In terms of its molecular structure, it consists of a vinyl group linked to a nitrile. It is an important monomer for the manufacture of useful plastics such as polyacrylonitrile. It is reactive and toxic at low doses.
Characteristics
23.8
0.25
Clear Liquid
0.8004 g/cm3 @ Temp: 25 °C
-82 °C
77.3 °C @ Press: 760 Torr
32 °F
1.385
H2O: soluble . 7.45 g/100 mL
2-8°C
86 mm Hg ( 20 °C)
1.83 (vs air)
Oral-Rat LD50: 78 mg/kg;Oral-Mouse LD50: 27 mg/kg
It is flammable in case of open flame, high temperature and oxidant; burning produces toxic nitrogen oxide fumes; decomposing toxic gas in water
2.8-28%(V)
Practically odorless, or with a very slight odor of peach kernels
pH = 6.0-7.5
Safety Information
I
3
UN 1093 3/PG 1
3
45-11-23/24/25-37/38-41-43-51/53-39/23/24/25-62-63
53-9-16-45-61-36/37
AT5250000
F,T,N,Xn
The warehouse is ventilated, low temperature and dry; stored separately from oxidants, acids and alkalis
Explosive when mixed with air
Stable under recommended storage conditions.
P201-P210-P260-P280-P301 + P310-P311
H225-H301 + H311 + H331-H350-H370
UN 1093
Acrylonitrile Use and Manufacturing
The preparation method mainly uses the propylene ammoxidation method, using propylene, ammonia and oxygen in the air as raw materials, and reacts in the presence of a catalyst. The catalyst is mainly a compound containing phosphorus, molybdenum, and bismuth, and the mole of propylene, ammonia, and air The ratio is 1: (1 to 1.2): (1.8 to 2.3), the reaction temperature is 400 to 500°C, the reaction pressure is normal pressure, and the reactor is a fluidized bed. Reaction equation: CH2=CH2-CH3+NH3+3/2O2→CH2=CH-CN+3H2O The single-pass yield of acrylonitrile in this reaction is 60%-75%.
Manufacture of acrylic fibers.In the plastics, surface coatings, and adhesives industries.As a chemical intermediate in the synthesis of antioxidants, pharmaceuticals, dyes, surface-active agents, etc.In organic synthesis to introduce a cyanoethyl group.As a modifier for natural polymers.As a pesticide fumigant for stored grain.Experimentally to induce adrenal hemorrhagic necrosis in rats.
Analysis Methods
| Name | Column Shape | Active Phase(℃) | Retention index | Temperature Control | Method | Comments | Reference |
|---|---|---|---|---|---|---|---|
| Kovats' RI, non-polar column, isothermal | Capillary | BPX-5 | 540. | 30. | isothermal | 12. m/0.15 mm/0.25 μm, H2 | Aflalaye, A.Sternberg, R.Raulin, F.Vidal-Madjar, C.Gas chromatography of Titan's atmosphere. VI. Analysis of low-molecular-mass hydrocarbons and nitriles with BPX5 capillary columnsJ. Chromatogr. A1995, 708, 2, 283-291. |
| Kovats' RI, non-polar column, isothermal | Capillary | BPX-5 | 544. | 30. | isothermal | 12. m/0.15 mm/0.25 μm, H2 | Aflalaye, A.Sternberg, R.Raulin, F.Vidal-Madjar, C.Gas chromatography of Titan's atmosphere. VI. Analysis of low-molecular-mass hydrocarbons and nitriles with BPX5 capillary columnsJ. Chromatogr. A1995, 708, 2, 283-291. |
| Kovats' RI, non-polar column, isothermal | Capillary | CP Sil 5 CB | 496.4 | 20. | isothermal | 25. m/0.15 mm/2. μm, H2 | Do, L.Raulin, F.Gas chromatography of Titan's atmosphere. III. Analysis of low-molecular-weight hydrocarbons and nitriles with a CP-Sil-5 CB WCOT capillary columnJ. Chromatogr.1992, 591, 1-2, 297-301. |
| Kovats' RI, non-polar column, isothermal | Capillary | PoraPLOT Q | 476. | 100. | isothermal | 10. m/0.32 mm/10. μm, H2 | Do, L.Raulin, F.Gas chromatography of Titan's atmosphere. I. Analysis of low-molecular-weight hydrocarbons and nitriles with a PoraPLOT Q porous polymer coated open-tubular capillary columnJ. Chromatogr.1989, 481, 45-54. |
| Kovats' RI, non-polar column, isothermal | Capillary | PoraPLOT Q | 482. | 160. | isothermal | 10. m/0.32 mm/10. μm, H2 | Do, L.Raulin, F.Gas chromatography of Titan's atmosphere. I. Analysis of low-molecular-weight hydrocarbons and nitriles with a PoraPLOT Q porous polymer coated open-tubular capillary columnJ. Chromatogr.1989, 481, 45-54. |
Computed Properties
Molecular Weight:53.06
XLogP3:0.2
Hydrogen Bond Acceptor Count:1
Exact Mass:53.026549100
Monoisotopic Mass:53.026549100
Topological Polar Surface Area:23.8
Heavy Atom Count:4
Complexity:54.9
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
Price Analysis
- Data: 2026-10-27
- Price: 10900.00Yuan/mt
- Change: 0
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