Basic information
- CAS
51911-74-1- Standard SMILES
O=C(c1ccccc1)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1- InChIKey
FHIDEWWHKSJPTK-UHFFFAOYSA-N- Molecular formula
- C13H8N2O5
- Average molar mass
- 272.21 g/mol
- Monoisotopic mass
- 272.04332136
Names & identifiers
- Preferred name
- (3,5-Dinitrophenyl)(phenyl)methanone
- IUPAC
- (3,5-dinitrophenyl)-phenylmethanone
Names & synonyms
(3,5-dinitrophenyl)(phenyl)methanone51911-74-1DTXSID30292936Methanone, (3,5-dinitrophenyl)phenyl-RefChem:207427DTXCID90244077FHIDEWWHKSJPTK-UHFFFAOYSA-NNSC86516NCIOpen2_004957SCHEMBL214448SCHEMBL27659930NSC-86516
Show more names
AKOS022188961
Database identifiers
- CAS
51911-74-1- PubChem CID
- 257900
- DTXSID
DTXSID30292936- Nikkaji
- J3.326.425I
Properties
Computed structural properties
- XLogP
- 2.9
- Topological polar surface area
- 109 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 2
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 373
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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