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13709-42-7 molecular structure
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neodymium(3+) ion trifluoride

ChemBase ID: 98244
Molecular Formular: F3Nd
Molecular Mass: 201.2352096
Monoisotopic Mass: 198.90293266
SMILES and InChIs

SMILES:
[Nd+3].[F-].[F-].[F-]
Canonical SMILES:
[F-].[F-].[F-].[Nd+3]
InChI:
InChI=1S/3FH.Nd/h3*1H;/q;;;+3/p-3
InChIKey:
XRADHEAKQRNYQQ-UHFFFAOYSA-K

Cite this record

CBID:98244 http://www.chembase.cn/molecule-98244.html

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NAMES AND DATABASE IDS

NAMES AND DATABASE IDS

Names Database IDs
IUPAC name
neodymium(3+) ion trifluoride
IUPAC Traditional name
neodymium(3+) ion trifluoride
Synonyms
Neodymium(III) fluoride 99%
Neodymium(III) fluoride, anhydrous, REacton®
氟化钕(III), 无水, REacton®
CAS Number
13709-42-7
EC Number
237-253-3
MDL Number
MFCD00011135
PubChem SID
162084695
PubChem CID
10176576

DATA SOURCES

DATA SOURCES

All Sources Commercial Sources Non-commercial Sources
Data Source Data ID
PubChem 10176576 external link

CALCULATED PROPERTIES

CALCULATED PROPERTIES

JChem
H Acceptors H Donor
LogD (pH = 5.5) 0.3684526  LogD (pH = 7.4) 0.36924794 
Log P 0.14883864  Molar Refractivity 0.8725 cm3
Polarizability 0.45069772 Å3 Polar Surface Area 0.0 Å2
Rotatable Bonds Lipinski's Rule of Five true 
Acid pKa 3.17 

PROPERTIES

PROPERTIES

Physical Property Safety Information Product Information Bioassay(PubChem)
Apperance
Crystalline Lump expand Show data source
Melting Point
1410°C expand Show data source
1410°C expand Show data source
Boiling Point
2300°C expand Show data source
Density
6.5 expand Show data source
6.506 expand Show data source
Storage Warning
Harmful/Irritant/Hygroscopic/Store under Argon expand Show data source
Hygroscopic expand Show data source
RTECS
QO9500000 expand Show data source
European Hazard Symbols
Irritant Irritant (Xi) expand Show data source
Risk Statements
36/37/38 expand Show data source
Safety Statements
26-36-60 expand Show data source
26-37-60 expand Show data source
TSCA Listed
expand Show data source
GHS Pictograms
GHS07 expand Show data source
GHS Hazard statements
H315-H319-H335 expand Show data source
GHS Precautionary statements
P261-P305+P351+P338-P302+P352-P321-P405-P501A expand Show data source
Purity
99.9% (REO) expand Show data source
99.99% (REO) expand Show data source

DETAILS

DETAILS

REFERENCES

REFERENCES

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PATENTS

PATENTS

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INTERNET

INTERNET

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