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359-40-0 molecular structure
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oxalic difluoride

ChemBase ID: 9858
Molecular Formular: C2F2O2
Molecular Mass: 94.0170064
Monoisotopic Mass: 93.98663568
SMILES and InChIs

SMILES:
O=C(F)C(=O)F
Canonical SMILES:
FC(=O)C(=O)F
InChI:
InChI=1S/C2F2O2/c3-1(5)2(4)6
InChIKey:
HXQOOYKLTKQCRR-UHFFFAOYSA-N

Cite this record

CBID:9858 http://www.chembase.cn/molecule-9858.html

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NAMES AND DATABASE IDS

NAMES AND DATABASE IDS

Names Database IDs
IUPAC name
oxalic difluoride
IUPAC Traditional name
oxalyl fluoride
Synonyms
Oxalyl fluoride
Oxalyl fluoride
ethanedioyl difluoride
Oxalyl fluoride 97%
CAS Number
359-40-0
EC Number
206-630-4
MDL Number
MFCD00039219
PubChem SID
160973165
PubChem CID
9668
Wikipedia Title
Oxalyl_fluoride

DATA SOURCES

DATA SOURCES

All Sources Commercial Sources Non-commercial Sources

CALCULATED PROPERTIES

CALCULATED PROPERTIES

JChem
H Acceptors H Donor
LogD (pH = 5.5) 0.22772923  LogD (pH = 7.4) 0.22772923 
Log P 0.22772923  Molar Refractivity 12.8856 cm3
Polarizability 4.76297 Å3 Polar Surface Area 34.14 Å2
Rotatable Bonds Lipinski's Rule of Five true 

PROPERTIES

PROPERTIES

Physical Property Safety Information Product Information Bioassay(PubChem)
Melting Point
-20°C expand Show data source
-3°C expand Show data source
Boiling Point
26.6°C expand Show data source
-3°C expand Show data source
Flash Point
none°C expand Show data source
Storage Warning
Corrosive/Toxic expand Show data source
GAS, TOXIC BY INHALATION, CORROSIVE expand Show data source
RTECS
RO4350000 expand Show data source
MSDS Link
Download expand Show data source
TSCA Listed
true expand Show data source
Purity
97% expand Show data source

DETAILS

DETAILS

Apollo Scientific Apollo Scientific Wikipedia Wikipedia
Apollo Scientific Ltd - PC5364 external link
Cylinder - CGA 660 connection

REFERENCES

REFERENCES

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PATENTS

PATENTS

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INTERNET

INTERNET

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