1-Fluoro-9h-fluoren-9-one
Basic information
- CAS
1514-16-5- Standard SMILES
O=C1c2ccccc2-c2cccc(F)c21- InChIKey
WJRBIZJUWCBZCT-UHFFFAOYSA-N- Molecular formula
- C13H7FO
- Average molar mass
- 198.19 g/mol
- Monoisotopic mass
- 198.04809301
Names & identifiers
- Preferred name
- 1-Fluoro-9h-fluoren-9-one
- IUPAC
- 1-fluorofluoren-9-one
- English name
- 1-fluoro-9H-fluoren-9-one
- Molecular formula
- C13H7FO
- Molecular weight
- 198.19
Names & synonyms
1-fluoro-9h-fluoren-9-one1514-16-51-fluoro-9-fluorenone1-fluorofluoren-9-oneMFCD00032932NSC566991-Fluoro-fluoren-9-oneSCHEMBL20729999H-Fluoren-9-one, 1-fluoro-DTXSID20288585NSC-56699AKOS037645141
Show more names
1-FLUORO-9-FLUORENONE（WS201983）
1-FLUORO-9-FLUORENONEWS201983AS-57584SY335371CS-0060096W17181F546961
Database identifiers
- CAS
1514-16-5- PubChem CID
- 245129
- DTXSID
DTXSID20288585- Nikkaji
- J2.226.677B
Properties
Computed structural properties
- XLogP
- 3.7
- Topological polar surface area
- 17.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 0
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 276
Experimental & physicochemical properties
SpringerMaterials PropertiesChemical shift
Physicochemical properties
- Melting point
- 110 · 110-111.5 °C(Solv: ethanol (64-17-5))
- Boiling point
- 341.4 · 341.4±21.0 °C(Predicted)
- Density
- 1.329 · 1.329±0.06 g/cm3(Predicted)
- storage temp.
- 2 · 2-8°C
- form
- solid
- color
- Off-white to light yellow
- Symbol(GHS)
- 6 · GHS06
- Signal word
- Danger
- Hazard statements
- 301 · H301-H311-H331
- Precautionary statements
- 261 · P261-P264-P270-P271-P280-P302+P352-P304+P340-P310-P330-P361-P403+P233-P405-P501
- HS Code
- 2914790090 · 2914790090
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
- hs_code
- 2914790090
- Signal word
- Danger
- Symbol(GHS)
- GHS06
- Hazard statements
- H301-H311-H331
- Precautionary statements
- P261-P264-P270-P271-P280-P302+P352-P304+P340-P310-P330-P361-P403+P233-P405-P501
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Related reactions
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Compound notes
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