Molecular Structure of Iron(III) citrate (CAS NO.3522-50-7):
IUPAC Name: 2-hydroxypropane-1,2,3-tricarboxylate; iron(3+)
Empirical Formula: C6H5FeO7
Molecular Weight: 244.9447
H bond acceptors: 7
H bond donors: 4
Freely Rotating Bonds: 6
Polar Surface Area: 121.13 Å2
Flash Point: 155.2 °C
Enthalpy of Vaporization: 63.82 kJ/mol
Boiling Point: 309.6 °C at 760 mmHg
Vapour Pressure: 5.73E-05 mmHg at 25°C
InChI
InChI=1/C6H8O7.Fe/c7-3(8)1-6(13,5(11)12)2-4(9)10;/h13H,1-2H2,(H,7,8)(H,9,10)(H,11,12);/q;+3/p-3
Smiles
C(CC(=O)[O-])(CC(=O)[O-])(C(=O)[O-])O.[Fe+3]
Storage temp: Store at RT.
Stability: Stable. Incompatible with strong oxidizing agents
WGK Germany: 3
F: 8
Iron(III) citrate , with CAS number of 3522-50-7, can be called 1,2,3-Propanetricarboxylic acid, 2-hydroxy-, iron (3+) salt (1:1) ; Citric acid, iron (3+) salt (1:1) ; Iron(3+) 2-hydroxy-1,2,3-propanetricarboxylate ; Iron(3+) citrate .
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