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| CAS No.: | 84057-81-8 |
|---|---|
| Name: | POLYVINYLPYRROLIDONE |
| Molecular Structure: | |
|
|
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| Formula: | C16H20O8Zr |
| Molecular Weight: | 431.55 |
| Synonyms: | 2-Propenoicacid, 2-methyl-, zirconium(4+) salt (9CI);zirconium(4+) methacrylate;2-methylprop-2-enoate; zirconium; |
| EINECS: | 267-604-6 |
| Density: | 1.69 g/cm3 |
| Melting Point: | 225-230°C |
| Boiling Point: | 160.5 °C at 760 mmHg |
| Flash Point: | 74.2 °C |
| Solubility: | Solubility in water: insoluble, reacts slowly |
| Appearance: | Off-white solid |
| Hazard Symbols: |
 Xi
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| Risk Codes: | 36/37/38 |
| Safety: | 26-36/37/39 |
| PSA: | 20.31000 |
| LogP: | 0.69020 |
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- Total:30 Page 1 of 1 1
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Specification
The Zirconium methacrylate, with the cas registry number 84057-81-8 and EINECS registry number 267-604-6, has the systematic name of 2-methylprop-2-enoate; zirconium. It belongs to the product category of momomer. And the molecular formula of the chemical is C16H20O8Zr.
The characteristics of this chemical are as followings: (1)H-Bond Acceptor 8; (2)Rotatable Bond Count 0; (3)Exact Mass 430.020521; (4)MonoIsotopic Mass 430.020521; (5)Topological Polar Surface Area 161; (6)Heavy Atom Count 25; (7)Formal Charge 0; (8)Complexity 78; (9)Isotope Atom Count 0; (10)Defined Atom StereoCenter Count 0; (11)Undefined Atom StereoCenter Count 0; (12)Defined Bond StereoCenter Count 0; (13)Undefined Bond StereoCenter Count 0; (14)Covalently-Bonded Unit Count 5.
You should be cautious while dealing with this chemical. It irritates to eyes, respiratory system and skin. Therefore, you had better take the following instructions: Wear suitable protective clothing, gloves and eye/face protection, and if in case of contacting with eyes, rinse immediately with plenty of water and seek medical advice.
Addtionally, the following datas could be converted into the molecular structure:
(1)SMILES: [Zr].O=C([O-])C(C)=C.CC(=C)C([O-])=O.CC(=C)C([O-])=O.CC(=C)C([O-])=O
(2)InChI: InChI=1/4C4H6O2.Zr/c4*1-3(2)4(5)6;/h4*1H2,2H3,(H,5,6);/p-4
(3)InChIKey: CLDSHFDRKHPKBN-XBHQNQODAO