Basic information
- CAS
73927-08-9- Standard SMILES
O=[N+]([O-])c1cccc(SC2CCCCC2Cl)c1- InChIKey
VGGJONRPYFOQNS-UHFFFAOYSA-N- Molecular formula
- C12H14ClNO2S
- Average molar mass
- 271.76 g/mol
- Monoisotopic mass
- 271.0433776
Names & identifiers
- Preferred name
- 2-Chlorocyclohexyl(3-nitrophenyl)sulfide
- IUPAC
- 1-(2-chlorocyclohexyl)sulfanyl-3-nitrobenzene
- English name
- 2-Chlorocyclohexyl 3-nitrophenyl sulfide
- Molecular formula
- C12H14ClNO2S
- Molecular weight
- 271.76
Names & synonyms
73927-08-92-Chlorocyclohexyl(3-nitrophenyl)sulfideSulfide, 2-chlorocyclohexyl 3-nitrophenylNSC 203380Benzene, 1-((2-chlorocyclohexyl)thio)-3-nitro-Benzene, 1-[(2-chlorocyclohexyl)thio]-3-nitro-RefChem:259480Benzene, 1-((2-chlorocyclohexyl)thio)-3-nitro-(9CI)1-[(2-chlorocyclohexyl)sulfanyl]-3-nitrobenzeneNSC203380WLN: L6TJ ASR CNW& BGDTXSID00995083
Show more names
2-Chlorocyclohexyl 3-nitrophenyl sulfide
NSC-203380
Database identifiers
- CAS
73927-08-9- PubChem CID
- 99752
- DTXSID
DTXSID00995083- Nikkaji
- J90.664F
Properties
Computed structural properties
- XLogP
- 4.2
- Topological polar surface area
- 71.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 272
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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