2-Buten-1-one, 1-(9-anthryl)-4,4,4-trifluoro-3-trifluoromethyl-
Basic information
- CAS
100482-56-2- Standard SMILES
O=C(C=C(C(F)(F)F)C(F)(F)F)c1c2ccccc2cc2ccccc12- InChIKey
PYROREKRSROOQY-UHFFFAOYSA-N- Molecular formula
- C19H10F6O
- Average molar mass
- 368.3 g/mol
- Monoisotopic mass
- 368.06358391
Names & identifiers
- Preferred name
- 2-Buten-1-one, 1-(9-anthryl)-4,4,4-trifluoro-3-trifluoromethyl-
- IUPAC
- 1-anthracen-9-yl-4,4,4-trifluoro-3-(trifluoromethyl)but-2-en-1-one
- English name
- 1-(9-Anthryl)-4,4,4-trifluoro-3-trifluoromethyl-2-buten-1-one
- Molecular weight
- 0
Names & synonyms
100482-56-21-(9-Anthryl)-4,4,4-trifluoro-3-trifluoromethyl-2-buten-1-one2-BUTEN-1-ONE, 1-(9-ANTHRYL)-4,4,4-TRIFLUORO-3-TRIFLUOROMETHYL-DTXSID80143328RefChem:257867DTXCID90658192-Buten-1-one, 1-(9-anthracenyl)-4,4,4-trifluoro-3-(trifluoromethyl)-1-anthracen-9-yl-4,4,4-trifluoro-3-(trifluoromethyl)but-2-en-1-oneNSC1620511-(anthracen-9-yl)-4,4,4-trifluoro-3-(trifluoromethyl)but-2-en-1-oneNSC-1620512-Buten-1-one,4,4-trifluoro-3-(trifluoromethyl)-
Database identifiers
- CAS
100482-56-2- PubChem CID
- 57916
- DTXSID
DTXSID80143328- Nikkaji
- J65.759J
Properties
Computed structural properties
- XLogP
- 6.6
- Topological polar surface area
- 17.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 2
- Heavy atoms
- 26
- Formal charge
- 0
- Complexity
- 523
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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