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(6'-Acetyloxy-4,5,6,7-tetrafluoro-3-oxospiro[2-benzofuran-1,9'-xanthene]-3'-yl) acetate

HCID 3926573
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Basic information

CAS
185318-75-6
Standard SMILES
CC(=O)Oc1ccc2c(c1)Oc1cc(OC(C)=O)ccc1C21OC(=O)c2c(F)c(F)c(F)c(F)c21
InChIKey
WSBXKQXTMWKYEC-UHFFFAOYSA-N
Molecular formula
C24H12F4O7
Average molar mass
488.3 g/mol
Monoisotopic mass
488.05191537

Names & identifiers

Preferred name
(6'-Acetyloxy-4,5,6,7-tetrafluoro-3-oxospiro[2-benzofuran-1,9'-xanthene]-3'-yl) acetate
IUPAC
(6'-acetyloxy-4,5,6,7-tetrafluoro-3-oxospiro[2-benzofuran-1,9'-xanthene]-3'-yl) acetate
English name
3 4 5 6-Tetrafluorofluorescein diacetat&
Molecular formula
C24H12F4O7
Molecular weight
488.34

Names & synonyms

185318-75-64,5,6,7-Tetrafluoro-3-oxo-3H-spiro[isobenzofuran-1,9'-xanthene]-3',6'-diyl diacetate3,4,5,6-Tetrafluorofluorescein diacetate(6'-acetyloxy-4,5,6,7-tetrafluoro-3-oxospiro[2-benzofuran-1,9'-xanthene]-3'-yl) acetate3 4 5 6-TETRAFLUOROFLUORESCEIN DIACETAT&SCHEMBL6663597DTXSID30398003C24H12F4O7AS-86049G65992(6'-acetoxy-4,5,6,7-tetrafluoro-3-oxo-spiro[isobenzofuran-1,9'-xanthene]-3'-yl) acetate4,5,6,7-Tetrafluoro-3-oxo-3H-spiro[[2]benzofuran-1,9'-xanthene]-3',6'-diyl diacetate
Show more names
Spiro[isobenzofuran-1(3H),9'-[9H]xanthen]-3-one, 3',6'-bis(acetyloxy)-4,5,6,7-tetrafluoro-

Database identifiers

CAS
185318-75-6

Properties

Computed structural properties

XLogP
4
Topological polar surface area
88.1 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
11
Rotatable bonds
4
Heavy atoms
35
Formal charge
0
Complexity
846

Physicochemical properties

Boiling point
622.5 · 622.5±55.0 °C(Predicted)
Density
1.62 · 1.62±0.1 g/cm3(Predicted)
Symbol(GHS)
7 · GHS07
Signal word
Warning
Hazard statements
302 · H302-H315-H319-H335
Precautionary statements
280 · P280-P305+P351+P338

Safety & regulation

Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.

Safety data

Signal word
Warning
Symbol(GHS)
GHS07
Hazard statements
H302-H315-H319-H335
Precautionary statements
P280-P305+P351+P338

Related reactions

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Compound notes

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PubChem CID
3926573
DTXSID
DTXSID30398003