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Sodium ferric oxalate

CAT: 0286-S05360-01Size: 5 gDry Ice: NoHazardous: No
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CAS Number
555-34-0
Synonyms
Iron (III) sodium oxalate, Trisodium trioxalatoferrate
Pictogram
07 - Irritant
UDF Signal Word
Warning
MDL Number
MFCD00150477
Hazard Statement
H302 Harmful if swallowed; H312 Harmful in contact with skin; H315 Causes skin irritation; H320 Causes eye irritation; H332 Harmful if inhaled; H335 May cause respiratory irritation.
DOT Name
Not D.O.T.-Regulated
Precautions
P261 Avoid breathing dust/fume/gas/mist/vapors/spray; P280 Wear protective gloves/protective clothing/eye protection/face protection; P301+P312 IF SWALLOWED: call a POISON CENTER or doctor/physician IF you feel unwell; P302+P352 IF ON SKIN: wash with plenty of soap and water; P304+P340 IF INHALED: Remove victim to fresh air and Keep at rest in a position comfortable for breathing; P305+P351+P338 IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continue rinsing; P332+P313 IF SKIN irritation occurs: Get medical advice/attention.

Chemical Information

Trisodium trioxalatoferrate
CAS Number555-34-0
PubChem CID168920
IUPAC Nametrisodium;iron(3+);oxalate
Molecular FormulaC6FeNa3O12
Molecular Weight388.87
Topological Polar Surface Area241
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count12
Rotatable Bond Count0
Heavy Atom Count22
Formal Charge0
Complexity60
SMILES
C(=O)(C(=O)[O-])[O-].C(=O)(C(=O)[O-])[O-].C(=O)(C(=O)[O-])[O-].[Na+].[Na+].[Na+].[Fe+3]
InChI
InChI=1S/3C2H2O4.Fe.3Na/c3*3-1(4)2(5)6;;;;/h3*(H,3,4)(H,5,6);;;;/q;;;+3;3*+1/p-6
InChIKey
XIPRSXSGWQCSHH-UHFFFAOYSA-H
Chemical Structure
2D Structure
2D structure of Trisodium trioxalatoferrate
CAS: 555-34-0
CID: 168920
Formula: C6FeNa3O12
MW: 388.87
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight388.87
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count12
Rotatable Bond Count0
Exact Mass388.843219
Monoisotopic Mass388.843219
Topological Polar Surface Area241 Ų
Heavy Atom Count22
Formal Charge0
Complexity60.5
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count7
Compound Is CanonicalizedYes

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