7-Chloro-2,4-dinitroxanthen-9-one
Basic information
- CAS
148877-20-7- Standard SMILES
O=c1c2cc(Cl)ccc2oc2c([N+](=O)[O-])cc([N+](=O)[O-])cc12- InChIKey
BBMKNRKMALLWEU-UHFFFAOYSA-N- Molecular formula
- C13H5ClN2O6
- Average molar mass
- 320.64 g/mol
- Monoisotopic mass
- 319.9836136
Names & identifiers
- Preferred name
- 7-Chloro-2,4-dinitroxanthen-9-one
- IUPAC
- 7-chloro-2,4-dinitroxanthen-9-one
- English name
- 7-Chloro-2,4-dinitroxanthen-9-one
- Molecular formula
- C13H5ClN2O6
- Molecular weight
- 320.64
Names & synonyms
7-Chloro-2,4-dinitroxanthen-9-one148877-20-7DTXSID00348010RefChem:310550DTXCID90299082BBMKNRKMALLWEU-UHFFFAOYSA-N7-Chloro-2,4-dinitro-9H-xanthen-9-one7-Chloro-2,4-dinitro-9H-xanthen-9-one #9H-Xanthen-9-one, 7-chloro-2,4-dinitro-
Database identifiers
- CAS
148877-20-7- PubChem CID
- 629360
- DTXSID
DTXSID00348010
Properties
Computed structural properties
- XLogP
- 3.2
- Topological polar surface area
- 118 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 0
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 504
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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