perchloryl perchlorate

• ChemBase ID: 126978
• Molecular Formular: Cl2O7
• Molecular Mass: 182.9018
• Monoisotopic Mass: 181.9021077
• SMILES: O=[Cl](=O)(=O)O[Cl](=O)(=O)=O
• Canonical SMILES: O=[Cl](=O)(=O)O[Cl](=O)(=O)=O
• InChI: InChI=1S/Cl2O7/c3-1(4,5)9-2(6,7)8
• InChIKey: SCDFUIZLRPEIIH-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: perchloryl perchlorate
• IUPAC Traditional name: dichlorine heptoxide
• Synonyms: Chlorine(VII) oxide; Perchloric anhydride; (Perchloryloxy)chlorane trioxide; Dichlorine heptoxide

Database IDs

• CAS Number: 10294-48-1
• PubChem SID: 162221301
• PubChem CID: 123272
• CHEBI ID: 52356
• Chemspider ID: 109884
• Wikipedia Title: Dichlorine_heptoxide

CALCULATED PROPERTIES

• H Acceptors: 6
• H Donor: 0
• LogD (pH = 5.5): 0.40299794
• LogD (pH = 7.4): 0.40299794
• Log P: 0.40299794
• Molar Refractivity: 22.2802 cm^3
• Polarizability: 9.9428835 Å^3
• Polar Surface Area: 111.65 Å^2
• Rotatable Bonds: 2
• Lipinski's Rule of Five: true

PROPERTIES

Physical Property

• Apperance: colorless oil
• Melting Point: -91.5 °C
• Boiling Point: 82 °C
• Density: 1900 kg m^-3

Safety Information

• Main Hazard: oxidizer, contact explosive