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3794-64-7 molecular structure
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argentio 2,2,3,3,4,4,4-heptafluorobutanoate

ChemBase ID: 147734
Molecular Formular: C4AgF7O2
Molecular Mass: 320.8986224
Monoisotopic Mass: 319.88374878
SMILES and InChIs

SMILES:
C(=O)(C(C(C(F)(F)F)(F)F)(F)F)O[Ag]
Canonical SMILES:
[Ag]OC(=O)C(C(C(F)(F)F)(F)F)(F)F
InChI:
InChI=1S/C4HF7O2.Ag/c5-2(6,1(12)13)3(7,8)4(9,10)11;/h(H,12,13);/q;+1/p-1
InChIKey:
GPNIJXACCBKBEP-UHFFFAOYSA-M

Cite this record

CBID:147734 http://www.chembase.cn/molecule-147734.html

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NAMES AND DATABASE IDS

NAMES AND DATABASE IDS

Names Database IDs
IUPAC name
argentio 2,2,3,3,4,4,4-heptafluorobutanoate
IUPAC Traditional name
argentio 2,2,3,3,4,4,4-heptafluorobutanoate
Synonyms
Heptafluorobutyric acid silver salt
Silver heptafluorobutyrate
七氟丁酸 银盐
七氟丁酸银
CAS Number
3794-64-7
EC Number
223-266-1
MDL Number
MFCD00064197
PubChem SID
24858592
162241918
PubChem CID
60160801

DATA SOURCES

DATA SOURCES

All Sources Commercial Sources Non-commercial Sources
Data Source Data ID Price
Sigma Aldrich
307424 external link Add to cart Please log in.
Data Source Data ID
PubChem 60160801 external link

CALCULATED PROPERTIES

CALCULATED PROPERTIES

JChem
H Acceptors H Donor
LogD (pH = 5.5) 2.6036  LogD (pH = 7.4) 2.6036 
Log P 2.6036  Molar Refractivity 22.0623 cm3
Polarizability 13.979487 Å3 Polar Surface Area 26.3 Å2
Rotatable Bonds Lipinski's Rule of Five true 

PROPERTIES

PROPERTIES

Physical Property Safety Information Product Information Bioassay(PubChem)
Apperance
powder expand Show data source
Melting Point
292-294 °C(lit.) expand Show data source
RTECS
EK7875000 expand Show data source
European Hazard Symbols
Irritant Irritant (Xi) expand Show data source
MSDS Link
Download expand Show data source
German water hazard class
2 expand Show data source
Risk Statements
41 expand Show data source
Safety Statements
26-37/39 expand Show data source
GHS Pictograms
GHS05 expand Show data source
GHS Signal Word
Danger expand Show data source
GHS Hazard statements
H318 expand Show data source
GHS Precautionary statements
P280-P305 + P351 + P338 expand Show data source
Personal Protective Equipment
dust mask type N95 (US), Eyeshields, Gloves expand Show data source
Purity
97% expand Show data source
Linear Formula
CF3CF2CF2CO2Ag expand Show data source

DETAILS

DETAILS

Sigma Aldrich Sigma Aldrich
Sigma Aldrich - 307424 external link
Packaging
5 g in glass bottle

REFERENCES

REFERENCES

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PATENTS

PATENTS

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INTERNET

INTERNET

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