gadolinium(3+) ion hydrate trichloride

• ChemBase ID: 107434
• Molecular Formular: Cl3GdO
• Molecular Mass: 279.6084
• Monoisotopic Mass: 278.82557566
• SMILES: O.[Cl-].[Cl-].[Cl-].[Gd+3]
• Canonical SMILES: O.[Cl-].[Cl-].[Cl-].[Gd+3]
• InChI: InChI=1S/3ClH.Gd.H2O/h3*1H;;1H2/q;;;+3;/p-3
• InChIKey: SXVCBXHAHBCOMV-UHFFFAOYSA-K

NAMES AND DATABASE IDS

Names

• IUPAC name: gadolinium(3+) ion hydrate trichloride
• IUPAC Traditional name: gadolinium(3+) hydrate trichloride
• Synonyms: GADOLINIUM CHLORIDE

Database IDs

• CAS Number: 19423-81-5
• PubChem SID: 162093237
• PubChem CID: 186043

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

Product Information

• Purity: 99.9%

DETAILS

MP Biomedicals - 05203712

MP Biomedicals Rare Chemical collection