tricyclo[3.3.1.13,7]tetraarsoxane

• ChemBase ID: 110431
• Molecular Formular: As4O6
• Molecular Mass: 395.6828
• Monoisotopic Mass: 395.65587172
• SMILES: O1[As]2O[As]3O[As]1O[As](O2)O3
• Canonical SMILES: O1[As]2O[As]3O[As]1O[As](O2)O3
• InChI: InChI=1S/As4O6/c5-1-6-3-8-2(5)9-4(7-1)10-3
• InChIKey: KTTMEOWBIWLMSE-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: tricyclo[3.3.1.1^3,^7]tetraarsoxane; tricyclo[3.3.1.1^{3,7}]tetraarsoxane
• IUPAC Traditional name: arsenic(III) oxide; diarsenic trioxide
• Synonyms: Arsenic(III) oxide; Arsenic(III) oxide, Puratronic®; Arsenic trioxide; Arsenic(III) oxide, primary standard, ACS; ARSENIOUS OXIDE; 氧化砷(III); 氧化砷, Puratronic®; 氧化砷, 基准物, ACS

Database IDs

• CAS Number: 1327-53-3
• EC Number: 215-481-4
• MDL Number: MFCD00003433
• Merck Index: 14804
• PubChem SID: 162096987
• PubChem CID: 518605

CALCULATED PROPERTIES

• H Acceptors: 6
• H Donor: 0
• LogD (pH = 5.5): 4.6272
• LogD (pH = 7.4): 4.6272
• Log P: 4.6272
• Molar Refractivity: 8.1012 cm^3
• Polarizability: 20.40146 Å^3
• Polar Surface Area: 55.38 Å^2
• Rotatable Bonds: 0
• Lipinski's Rule of Five: true

PROPERTIES

Physical Property

• Solubility: Slightly soluble in cold water. Soluble in boiling water, HCl, alkali hydroxide. Insoluble in alcohol, chloroform, and ether
• Apperance: -100 Mesh Powder; Powder
• Melting Point: 312.3°C
• Boiling Point: 465°C subl.
• Density: 3.74

Safety Information

• RTECS: CG3325000
• European Hazard Symbols: Nature polluting (N); Highly toxic (T+)
• UN Number: UN1561
• Hazard Class: 6.1
• Packing Group: II
• Risk Statements: 45-28-34-50/53; R:28-34-45-50/53
• Safety Statements: 53-45-60-61; S:45-53-60-61
• TSCA Listed: 是
• GHS Pictograms: GHS05; GHS06; GHS08; GHS09
• GHS Hazard statements: H300-H350-H314-H318-H400-H410
• GHS Precautionary statements: P260-P301+P310-P303+P361+P353-P305+P351+P338-P405-P501A

Product Information

• Purity: 99.5% (metals basis); 99.95-100.05%; 99.996% (metals basis excluding Sb), Sb 20ppm max

DETAILS

MP Biomedicals - 05214987

MP Biomedicals Rare Chemical collection