Iron(III) p-toluenesulfonate supplier

Name
Iron(III) p-toluenesulfonate
EINECS 420-960-8
CAS No. 77214-82-5
Density 1.52 at 20℃
Solubility
Melting Point
Formula C₂₁H₂₁FeO₉S₃
Boiling Point
Molecular Weight 569.43
Flash Point
Transport Information
Appearance
Safety 24-26-39
Risk Codes 41
Molecular Structure
Hazard Symbols Xi
Synonyms Benzenesulfonicacid, 4-methyl-, iron(3+) salt (9CI);Baytron C;Baytron C-B 40;Baytron C-B 40High Fe;Baytron C-B 50;Baytron C-E;Ferrictosylate;Iron tris(4-toluenesulfonate);Iron(3+) tosylate;Iron(III) tris(toluenesulfonate);p-Toluenesulfonic acid ferric salt;
PSA 196.74000
LogP 5.93720

Iron(III) p-toluenesulfonate Specification

The Iron(III) p-toluenesulfonate, with the CAS registry number 77214-82-5, is also known as Tris(toluenesulfonate)iron(III). It belongs to the product category of Thiophen. Its EINECS registry number is 420-960-8. This chemical's molecular formula is C₂₁H₂₁FeO₉S₃ and molecular weight is 569.426. What's more, its IUPAC name is Iron(3+); 4-methylbenzenesulfonate.

Physical properties about Iron(III) p-toluenesulfonate are: (1)ACD/LogP: 0.93; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): -2.57; (4)ACD/LogD (pH 7.4): -2.57; (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: 3; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 1; (12)Polar Surface Area: 62.75 Å².

When you are dealing with this chemical, you should be very careful. This chemical can risk of serious damage to eyes. Therefore, you should wear eye/face protection and avoid contacting with skin. And if in case of contacting with eyes, you should rise immediately with plenty of water and seek medical advice.

You can still convert the following datas into molecular structure:
(1) SMILES: [Fe+3].O=S([O-])(=O)c1ccc(cc1)C.[O-]S(=O)(=O)c1ccc(cc1)C.[O-]S(=O)(=O)c1ccc(cc1)C
(2) InChI: InChI=1/3C7H8O3S.Fe/c3*1-6-2-4-7(5-3-6)11(8,9)10;/h3*2-5H,1H3,(H,8,9,10);/q;;;+3/p-3
(3) InChIKey: FYMCOOOLDFPFPN-DFZHHIFOAN

The toxicity data is as follows:

Organism	Test Type	Route	Reported Dose (Normalized Dose)	Effect	Source
rat	LDLo	oral	1500mg/kg (1500mg/kg)	BEHAVIORAL: SOMNOLENCE (GENERAL DEPRESSED ACTIVITY) GASTROINTESTINAL: CHANGES IN STRUCTURE OR FUNCTION OF SALIVARY GLANDS SKIN AND APPENDAGES (SKIN): HAIR: OTHER	Acute Toxicity Data. Journal of the American College of Toxicology, Part B. Vol. 15

Product Name

Iron(III) p-toluenesulfonate

Iron(III) p-toluenesulfonate Specification

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