iodo(2H)

• ChemBase ID: 134621
• Molecular Formular: HI
• Molecular Mass: 127.91241
• Monoisotopic Mass: 127.91229803
• SMILES: I
• Canonical SMILES: I
• InChI: InChI=1S/HI/h1H
• InChIKey: XMBWDFGMSWQBCA-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: iodo(^2H)
• IUPAC Traditional name: iodo(^2H)
• Synonyms: Deuterium iodide solution; Deuterium iodide; 碘化氘 溶液; 碘化氘

Database IDs

• CAS Number: 14104-45-1
• EC Number: 237-958-6
• MDL Number: MFCD00064504
• PubChem SID: 162228897
• PubChem CID: 518878

CALCULATED PROPERTIES

• Acid pKa: -9.0
• H Acceptors: 0
• H Donor: 0
• LogD (pH = 5.5): 1.2409753
• LogD (pH = 7.4): 1.2409753
• Log P: 1.0205557
• Molar Refractivity: 14.7462 cm^3
• Polarizability: 6.123149 Å^3
• Polar Surface Area: 0.0 Å^2
• Rotatable Bonds: 0
• Lipinski's Rule of Five: true

PROPERTIES

Physical Property

• Apperance: gas
• Boiling Point: -35.1 °C(lit.)
• Mass Shift: M+1

Safety Information

• European Hazard Symbols: Corrosive (C)
• UN Number: 1787; 2197
• German water hazard class: 1
• Hazard Class: 2.3; 8
• Packing Group: 2
• Risk Statements: 20/21/22-34; 34
• Safety Statements: 26-27-36/37/39-45; 26-45
• GHS Pictograms: GHS04; GHS05
• GHS Signal Word: Danger
• GHS Hazard statements: H314
• GHS Precautionary statements: P280-P305 + P351 + P338-P310
• RID/ADR: UN 1787 8/PG 2; UN 2197 2.3

Product Information

• Concentration: 53 wt. % in D2O
• Isotopic Purity: ≥99 atom % D; 98 atom % D
• Contains: 1.5% deuterium phosphate as stabilizer
• Linear Formula: DI
• Empirical Formula (Hill Notation): DI

DETAILS

Sigma Aldrich - 176664

Packaging
Packaged in prescored ampules

Sigma Aldrich - 596655

Packaging
This product may be available from bulk stock and can be packaged on demand. For information on pricing, availability and packaging, please contact Stable Isotopes Customer Service.