6-(Methylsulfonyl)-2-nitro-9h-fluoren-9-one
Basic information
- CAS
22010-40-8- Standard SMILES
CS(=O)(=O)c1ccc2c(c1)-c1ccc([N+](=O)[O-])cc1C2=O- InChIKey
PCWMOJYWKRJWCQ-UHFFFAOYSA-N- Molecular formula
- C14H9NO5S
- Average molar mass
- 303.29 g/mol
- Monoisotopic mass
- 303.02014356
Names & identifiers
- Preferred name
- 6-(Methylsulfonyl)-2-nitro-9h-fluoren-9-one
- IUPAC
- 6-methylsulfonyl-2-nitrofluoren-9-one
Names & synonyms
22010-40-86-(methylsulfonyl)-2-nitro-9h-fluoren-9-oneNSC1096499H-Fluoren-9-one,6-(methylsulfonyl)-2-nitro-DTXSID90296511NSC-109649DS-0093876-(Methanesulfonyl)-2-nitro-9H-fluoren-9-one
Database identifiers
- CAS
22010-40-8- PubChem CID
- 269100
- DTXSID
DTXSID90296511
Properties
Computed structural properties
- XLogP
- 2.3
- Topological polar surface area
- 105 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 1
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 561
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Compound notes
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