1-phospha-2,3,4-triferratricyclo[1.1.0.02,4]butane

• ChemBase ID: 141455
• Molecular Formular: Fe3P
• Molecular Mass: 198.508761
• Monoisotopic Mass: 198.77857413
• SMILES: P12[Fe]3[Fe]1[Fe]23
• Canonical SMILES: [Fe]12[Fe]3[Fe]1P23
• InChI: InChI=1S/3Fe.P
• InChIKey: KFSKMQQNHSLZRJ-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: 1-phospha-2,3,4-triferratricyclo[1.1.0.0^2,^4]butane
• IUPAC Traditional name: 1-phospha-2,3,4-triferratricyclo[1.1.0.0^2,^4]butane
• Synonyms: Iron phosphide, Fe3P; Iron phosphide; 磷化铁

Database IDs

• CAS Number: 12023-53-9
• EC Number: 234-682-8
• MDL Number: MFCD00799762
• PubChem SID: 162235689
• PubChem CID: 71310637

CALCULATED PROPERTIES

• H Acceptors: 0
• H Donor: 0
• LogD (pH = 5.5): 1.3160174
• LogD (pH = 7.4): 1.5239168
• Log P: 1.5308
• Molar Refractivity: 6.836 cm^3
• Polarizability: 12.11682 Å^3
• Polar Surface Area: 0.0 Å^2
• Rotatable Bonds: 0
• Lipinski's Rule of Five: true

PROPERTIES

Physical Property

• Apperance: -40 Mesh Powder; powder

Safety Information

• European Hazard Symbols: Irritant (Xi)
• German water hazard class: 3
• Risk Statements: 36/37/38
• Safety Statements: 26
• TSCA Listed: 是
• GHS Pictograms: GHS07
• GHS Signal Word: Warning
• GHS Hazard statements: H315-H319-H335
• GHS Precautionary statements: P261-P305 + P351 + P338
• Personal Protective Equipment: dust mask type N95 (US), Eyeshields, Gloves

Product Information

• Purity: 99.5% (metals basis); 99.5% trace metals basis
• Particle Size: -40 mesh
• Linear Formula: Fe3P

DETAILS

Sigma Aldrich - 691593

Packaging
5 g in glass bottle