- Ferene disodium salt
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| Name |
Ferene disodium salt |
EINECS | 629-460-6 |
| CAS No. | 79551-14-7 | Density | 1.188?g/mL?at 25?°C(lit.) |
| PSA | 209.00000 | LogP | 3.42340 |
| Solubility | N/A | Melting Point |
46-49?°C(lit.) |
| Formula | C16H10N4O8S2.2Na | Boiling Point | 160-162?°C(lit.) |
| Molecular Weight | 496.37 | Flash Point | >230?°F |
| Transport Information | N/A | Appearance | N/A |
| Safety | 26-36 | Risk Codes | 36/37/38 |
| Molecular Structure |
|
Hazard Symbols |
 Xi
|
| Synonyms |
2-Furansulfonicacid, 5,5'-[3-(2-pyridinyl)-1,2,4-triazine-5,6-diyl]bis-, disodium salt (9CI);Ferene;Ferene S;NSC 601364; |
Ferene disodium salt Synthetic route
- 7439-89-6
iron(II)
- 79551-14-7
3-(2-pyridyl)-5,6-bis(2-(5-furyl sulfonic acid)-1,2,4-triazine), disodium salt
| Conditions | Yield |
|---|---|
| With hydroxylamine hydrochloride In further solvent(s) Kinetics; iron, complexone and hydroxylamine as reducing agent mixed with acetatebuffer, 1 M HCl or 1 M NaOH added to adjust required pH in a range 1-10; detected by UV spectroscopy; |
Ferene disodium salt Specification
This chemical is called Ferene-S, and its systematic name is 2-Furansulfonic acid, 5,5'-(3-(2-pyridinyl)-1,2,4-triazine-
5,6-diyl)bis-, disodium salt. With the molecular formula of C16H10N4O8S2.2Na, its molecular weight is 496.37. The CAS registry number of this chemical is 79551-14-7.
Other characteristics of the Ferene-S can be summarised as followings: (1)ACD/LogP: -1.04; (2)# of Rule of 5 Violations: 1; (3)#H bond acceptors: 12; (4)#H bond donors: 2; (5)#Freely Rotating Bonds: 5; (6)Polar Surface Area: 203.34 Å2.
When you are using this chemical, please be cautious about it as the following: 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.
You can still convert the following datas into molecular structure:
1.SMILES: [Na+].[Na+].O=S([O-])(=O)c4oc(c1nnc(nc1c2oc(cc2)S([O-])(=O)=O)c3ncccc3)cc4
2.InChI: InChI=1/C16H10N4O8S2.2Na/c21-29(22,23)12-6-4-10(27-12)14-15(11-5-7-13(28-11)30(24,25)26)19-20-16(18-14)9-3-1-2-8-17-9;;/h1-8H,(H,21,22,23)(H,24,25,26);;/q;2*+1/p-2
3.InChIKey: IVLSEFOVPQFJBB-NUQVWONBAC
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