1-arsa-2,3-diferracycloprop-1-ene

• ChemBase ID: 142870
• Molecular Formular: AsFe2H
• Molecular Mass: 187.61954
• Monoisotopic Mass: 187.79929603
• SMILES: [Fe]1=[AsH][Fe]1
• Canonical SMILES: [Fe]1[Fe]=[AsH]1
• InChI: InChI=1S/As.2Fe
• InChIKey: FDKAYGUKROYPRO-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: 1-arsa-2,3-diferracycloprop-1-ene
• IUPAC Traditional name: 1-arsa-2,3-diferracycloprop-1-ene
• Synonyms: Iron arsenide; 砷化铁

Database IDs

• CAS Number: 12005-88-8
• EC Number: 234-474-7
• MDL Number: MFCD00151533
• PubChem SID: 162237096
• PubChem CID: 71310806

CALCULATED PROPERTIES

• H Acceptors: 0
• H Donor: 0
• LogD (pH = 5.5): 1.55
• LogD (pH = 7.4): 1.55
• Log P: 1.55
• Molar Refractivity: 0.0 cm^3
• Polarizability: 10.348897 Å^3
• Polar Surface Area: 0.0 Å^2
• Rotatable Bonds: 0
• Lipinski's Rule of Five: true

PROPERTIES

Physical Property

• Apperance: pieces
• Melting Point: >400 °C

Safety Information

• European Hazard Symbols: Nature polluting (N); Toxic (T)
• UN Number: 1557
• German water hazard class: 3
• Hazard Class: 6.1
• Packing Group: 3
• Risk Statements: 23/25-50/53
• Safety Statements: 20/21-28-45-60-61
• GHS Pictograms: GHS06; GHS09
• GHS Signal Word: Danger
• GHS Hazard statements: H301 + H331-H410
• GHS Precautionary statements: P261-P273-P301 + P310-P311-P501
• RID/ADR: UN 1557 6.1/PG 3

Product Information

• Purity: 99.5% trace metals basis
• Empirical Formula (Hill Notation): AsFe2

DETAILS

Sigma Aldrich - 709301

Packaging
1, 5 g in glass bottle