D-gluconic acid, iron(2+) salt, hydrate (2:1:1)

OSHA PEL: TWA 1 mg(Fe)/m³
ACGIH TLV: TWA 1 mg(Fe)/m³

The D-gluconic acid, iron(2+) salt, hydrate (2:1:1), with the CAS registry number 22830-45-1, is also known as Iron(II) gluconate dihydrate. It belongs to the product categories of Biochemistry; Classes of Metal Compounds; Fe (Iron) Compounds; Glucose; Sugar Acids; Sugars; Transition Metal Compounds. Its EINECS number is 206-076-3. This chemical's molecular formula is C₆H₁₂O₇·1/2 Fe·H₂O and molecular weight is 482.17. What's more, its systematic name is iron(2+) (2R,3S,4R,5R)-2,3,4,5,6-pentahydroxyhexanoate hydrate (1:2:2). Its classification code is Mutation data. It should be sealed and stored in a cool and dry place. Moreover, it should be protected from oxides.

Physical properties of D-gluconic acid, iron(2+) salt, hydrate (2:1:1) are: (1)ACD/LogP: -3.18; (2)# of Rule of 5 Violations: 1; (3)#H bond acceptors: 7; (4)#H bond donors: 6; (5)#Freely Rotating Bonds: 10; (6)Polar Surface Area: 83.45 Å²; (7)Flash Point: 375.2 °C; (8)Enthalpy of Vaporization: 113.2 kJ/mol; (9)Boiling Point: 673.6 °C at 760 mmHg; (10)Vapour Pressure: 4.95E-21 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: [Fe+2].[O-]C(=O)[C@H](O)[C@@H](O)[C@H](O)[C@H](O)CO.[O-]C(=O)[C@H](O)[C@@H](O)[C@H](O)[C@H](O)CO.O.O
(2)Std. InChI: InChI=1S/2C6H12O7.Fe.2H2O/c2*7-1-2(8)3(9)4(10)5(11)6(12)13;;;/h2*2-5,7-11H,1H2,(H,12,13);;2*1H2/q;;+2;;/p-2/t2*2-,3-,4+,5-;;;/m11.../s1
(3)Std. InChIKey: OKGNXSFAYMSVNN-SYAJEJNSSA-L

The toxicity data is as follows: