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16922-07-9 molecular structure
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terbium(3+) ion triacetate hydrate

ChemBase ID: 111325
Molecular Formular: C6H11O7Tb
Molecular Mass: 354.07268
Monoisotopic Mass: 353.97582369
SMILES and InChIs

SMILES:
O.[Tb+3].CC(=O)[O-].CC(=O)[O-].CC(=O)[O-]
Canonical SMILES:
[O-]C(=O)C.[O-]C(=O)C.[O-]C(=O)C.O.[Tb+3]
InChI:
InChI=1S/3C2H4O2.H2O.Tb/c3*1-2(3)4;;/h3*1H3,(H,3,4);1H2;/q;;;;+3/p-3
InChIKey:
CUFVJHPGFMTTMB-UHFFFAOYSA-K

Cite this record

CBID:111325 http://www.chembase.cn/molecule-111325.html

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NAMES AND DATABASE IDS

NAMES AND DATABASE IDS

Names Database IDs
IUPAC name
terbium(3+) ion triacetate hydrate
IUPAC Traditional name
terbium(3+) tris(acetate ion) hydrate
terbium(3+) ion triacetate hydrate
Synonyms
TERBIUM ACETATE
Terbium(III) acetate hydrate
Terbium(III) acetate hydrate, REacton®
水合乙酸铽(III)
水合乙酸铽(III), REacton®
CAS Number
16922-07-9
100587-92-6
MDL Number
MFCD00149233
PubChem SID
162096796
PubChem CID
19013755

DATA SOURCES

DATA SOURCES

All Sources Commercial Sources Non-commercial Sources
Data Source Data ID
PubChem 19013755 external link

CALCULATED PROPERTIES

CALCULATED PROPERTIES

JChem
Acid pKa 4.54344  H Acceptors
H Donor LogD (pH = 5.5) -1.2242727 
LogD (pH = 7.4) -2.9968748  Log P -0.22334571 
Molar Refractivity 23.4808 cm3 Polarizability 4.912116 Å3
Polar Surface Area 40.13 Å2 Rotatable Bonds
Lipinski's Rule of Five true 

PROPERTIES

PROPERTIES

Physical Property Safety Information Product Information Bioassay(PubChem)
Apperance
Crystalline Aggregates expand Show data source
MSDS Link
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TSCA Listed
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Purity
99.9% expand Show data source
99.9% (REO) expand Show data source
99.99% expand Show data source
Certificate of Analysis
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DETAILS

DETAILS

MP Biomedicals MP Biomedicals
MP Biomedicals - 05218632 external link
MP Biomedicals Rare Chemical collection

REFERENCES

REFERENCES

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PATENTS

PATENTS

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INTERNET

INTERNET

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