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| CAS No.: | 25102-12-9 |
|---|---|
| Name: | Ethylenediaminetetraacetic acid dipotassium salt dihydrate |
| Molecular Structure: | |
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| Formula: | C10H18K2N2O10 |
| Molecular Weight: | 404.45 |
| Synonyms: | Aceticacid, (ethylenedinitrilo)tetra-, dipotassium salt, dihydrate (8CI);Glycine,N,N'-1,2-ethanediylbis[N-(carboxymethyl)-, dipotassium salt, dihydrate (9CI);Ethylenediamine-N,N,N',N'-tetraacetic acid dipotassium salt, dihydrate;Ethylenediaminetetraacetic acid dipotassium salt dihydrate; |
| EINECS: | 217-895-0 |
| Melting Point: | 255-280 °C (dec.)(lit.) |
| Boiling Point: | 614.2 °C at 760 mmHg |
| Flash Point: | 325.2 °C |
| Solubility: | soluble |
| Appearance: | white fine crystalline powder |
| Hazard Symbols: |
 Xi
|
| Risk Codes: | 36/37/38 |
| Safety: | 26-36-37/39 |
| PSA: | 179.80000 |
| LogP: | -4.86920 |
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Specification
1.Introduction of Ethylenediaminetetraacetic acid dipotassium salt dihydrate
The Ethylenediaminetetraacetic acid dipotassium salt dihydrate, with its CAS NO 25102-12-9, is a kind of fine crystalline powder. It has synonyms of Aceticacid, (ethylenedinitrilo)tetra-, dipotassium salt, dihydrate (8CI);Glycine,N,N'-1,2-ethanediylbis[N-(carboxymethyl)-, dipotassium salt, dihydrate (9CI) and Ethylenediamine-N,N,N',N'-tetraacetic acid dipotassium salt, dihydrate.
2. Properties of Ethylenediaminetetraacetic acid dipotassium salt dihydrate
(1)ACD/LogP: -0.43; (2)# of Rule of 5 Violations: 1; (3)ACD/LogD (pH 5.5): -5.49; (4)ACD/LogD (pH 7.4): -5.92; (5)ACD/BCF (pH 5.5): 1; (6)ACD/BCF (pH 7.4): 1; (7)ACD/KOC (pH 5.5): 1; (8)ACD/KOC (pH 7.4): 1; (9)#H bond acceptors: 10; (10)#H bond donors: 4; (11)#Freely Rotating Bonds: 11; (12)Polar Surface Area: 133.68 Å2; (13)Flash Point: 325.2 °C; (14)Enthalpy of Vaporization: 99.5 kJ/mol; (15)Boiling Point: 614.2 °C at 760 mmHg; (16)Vapour Pressure: 1.15E-16 mmHg at 25°C.
3. Structure descriptors of Ethylenediaminetetraacetic acid dipotassium salt dihydrate
1.SMILES: [K+].[K+].[O-]C(=O)CN(CCN(CC([O-])=O)CC(=O)O)CC(=O)O.O.O
2.InChI: InChI=1/C10H16N2O8.2K.2H2O/c13-7(14)3-11(4-8(15)16)1-2-12(5-9(17)18)6-10(19)20;;;;/h1-6H2,(H,13,14)(H,15,16)(H,17,18)(H,19,20);;;2*1H2/q;2*+1;;/p-2
3.InChIKey: JFROQFOCFOKDKU-NUQVWONBAJ
4. Safety information of Ethylenediaminetetraacetic acid dipotassium salt dihydrate
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.