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Basic information
- Standard SMILES
O=[N+]([O-])c1ccc(SCl)c(C(Cl)(Cl)Cl)c1- InChIKey
VEHPHYNMEBFZPZ-UHFFFAOYSA-N- Molecular formula
- C7H3Cl4NO2S
- Average molar mass
- 307 g/mol
- Monoisotopic mass
- 304.86386
Names & identifiers
- Preferred name
- 4-Nitro-2-trichloromethylbenzenesulfenyl chloride
- IUPAC
- [4-nitro-2-(trichloromethyl)phenyl] thiohypochlorite
Names & synonyms
SCHEMBL11122741VEHPHYNMEBFZPZ-UHFFFAOYSA-N4-nitro-2-trichloromethylbenzenesulfenyl chloride2-trichloromethyl-4-nitrobenzenesulfenic acid chloride
Database identifiers
- PubChem CID
- 12763555
Properties
Computed structural propertiesFilling in
- XLogP
- 4.3
- Topological polar surface area
- 71.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 0
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 242
Related reactions
27 records
Compound notes
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