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14481-29-9 molecular structure
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tetraammonium hexacyanoirontetrauide

ChemBase ID: 105720
Molecular Formular: C6H16FeN10
Molecular Mass: 284.10324
Monoisotopic Mass: 284.09087806
SMILES and InChIs

SMILES:
[NH4+].[NH4+].[NH4+].[NH4+].N#C[Fe-4](C#N)(C#N)(C#N)(C#N)C#N
Canonical SMILES:
N#C[Fe-4](C#N)(C#N)(C#N)(C#N)C#N.[NH4+].[NH4+].[NH4+].[NH4+]
InChI:
InChI=1S/6CN.Fe.4H3N/c6*1-2;;;;;/h;;;;;;;4*1H3/q;;;;;;-4;;;;/p+4
InChIKey:
MCPSSNGNEXEJSZ-UHFFFAOYSA-R

Cite this record

CBID:105720 http://www.chembase.cn/molecule-105720.html

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NAMES AND DATABASE IDS

NAMES AND DATABASE IDS

Names Database IDs
IUPAC name
tetraammonium hexacyanoirontetrauide
IUPAC Traditional name
tetraammonium ferrocyanide
Synonyms
Ammonium ferrocyanide
Ammonium hexacyanoferrate(II) hydrate
Ammonium hexacyanoferrate[II]
AMMONIUM FERROCYANIDE
水合六氰高铁酸铵(II)
CAS Number
14481-29-9
EC Number
238-476-9
MDL Number
MFCD00149957
Merck Index
14520
PubChem SID
162092830
PubChem CID
17756740

DATA SOURCES

DATA SOURCES

All Sources Commercial Sources Non-commercial Sources
Data Source Data ID
PubChem 17756740 external link

CALCULATED PROPERTIES

CALCULATED PROPERTIES

JChem
H Acceptors H Donor
LogD (pH = 5.5) -0.2594  LogD (pH = 7.4) -0.2594 
Log P -0.2594  Molar Refractivity 39.9336 cm3
Polarizability 15.723072 Å3 Polar Surface Area 142.74 Å2
Rotatable Bonds Lipinski's Rule of Five true 

PROPERTIES

PROPERTIES

Physical Property Safety Information Product Information Bioassay(PubChem)
Melting Point
1539 °C expand Show data source
Boiling Point
2735 °C at 1013 hPa expand Show data source
Auto Ignition Point
> 100 °C expand Show data source
Density
7.87 g/cm3 at 25 °C expand Show data source
Vapor Pressure
ca. .000001 hPa at 25 °C expand Show data source
Storage Condition
Room Temperature (15-30°C), Desiccate, Protect from light expand Show data source
Storage Warning
Light Sensitive & Hygroscopic expand Show data source
European Hazard Symbols
Irritant Irritant (Xi) expand Show data source
MSDS Link
Download expand Show data source
Risk Statements
52/53 expand Show data source
R:36/37/38 expand Show data source
Safety Statements
61 expand Show data source
S:20-25-26-37/39 expand Show data source
TSCA Listed
expand Show data source
GHS Hazard statements
H402-H412 expand Show data source
GHS Precautionary statements
P273-P501A expand Show data source
Purity
90% expand Show data source
ca 10% water expand Show data source
Certificate of Analysis
Download expand Show data source

DETAILS

DETAILS

MP Biomedicals MP Biomedicals

REFERENCES

REFERENCES

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PATENTS

PATENTS

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INTERNET

INTERNET

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