(2,4-Dinitrophenyl) methanesulfonate
Basic information
- CAS
7155-37-5- Standard SMILES
CS(=O)(=O)Oc1ccc([N+](=O)[O-])cc1[N+](=O)[O-]- InChIKey
OBNLOECNGJKOMP-UHFFFAOYSA-N- Molecular formula
- C7H6N2O7S
- Average molar mass
- 262.2 g/mol
- Monoisotopic mass
- 261.98957171
Names & identifiers
- Preferred name
- (2,4-Dinitrophenyl) methanesulfonate
- IUPAC
- (2,4-dinitrophenyl) methanesulfonate
Names & synonyms
7155-37-5(2,4-dinitrophenyl) methanesulfonate2,4-dinitrophenyl methanesulfonate(2,4-dinitrophenyl)methanesulfonateNSC197852,4-dinitrophenyl mesylateDTXSID50281024NSC-19785
Database identifiers
- CAS
7155-37-5- PubChem CID
- 227765
- DTXSID
DTXSID50281024
Properties
Computed structural properties
- XLogP
- 1.1
- Topological polar surface area
- 143 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 2
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 403
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Related reactions
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Compound notes
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