sodium dihydrate iodide

• ChemBase ID: 148733
• Molecular Formular: INaO2
• Molecular Mass: 181.89304
• Monoisotopic Mass: 181.88407152
• SMILES: O.O.[Na+].[I-]
• Canonical SMILES: O.O.[Na+].[I-]
• InChI: InChI=1S/HI.Na.2H2O/h1H;;2*1H2/q;+1;;/p-1
• InChIKey: VEEIYHUOLCUPSA-UHFFFAOYSA-M

NAMES AND DATABASE IDS

Names

• IUPAC name: sodium dihydrate iodide
• IUPAC Traditional name: sodium dihydrate iodide
• Synonyms: Sodium iodide dihydrate; 碘化钠 二水合物

Database IDs

• CAS Number: 13517-06-1
• EC Number: 231-679-3
• MDL Number: MFCD00149211
• PubChem SID: 24853008; 162242908
• PubChem CID: 23685997

CALCULATED PROPERTIES

• Acid pKa: 15.7
• H Acceptors: 1
• H Donor: 1
• LogD (pH = 5.5): -0.652
• LogD (pH = 7.4): -0.652
• Log P: -0.652
• Molar Refractivity: 3.7 cm^3
• Polarizability: 1.4714895 Å^3
• Polar Surface Area: 25.3 Å^2
• Rotatable Bonds: 0
• Lipinski's Rule of Five: true

PROPERTIES

Physical Property

• Apperance: crystalline
• Density: 2.448 g/mL at 25 °C(lit.)
• Vapor Density: >1 (vs air)

Safety Information

• European Hazard Symbols: Irritant (Xi)
• German water hazard class: 1
• Risk Statements: 36/38
• Safety Statements: 26
• GHS Pictograms: GHS07
• GHS Signal Word: Warning
• GHS Hazard statements: H315-H319
• GHS Precautionary statements: P305 + P351 + P338
• Personal Protective Equipment: dust mask type N95 (US), Eyeshields, Gloves

Product Information

• Purity: ≥99%
• Linear Formula: NaI·2H2O

DETAILS

Sigma Aldrich - 217301

Packaging
100, 500 g in glass bottle