8-(2-Nitrophenyl)sulfanylquinoline
Basic information
- CAS
107916-45-0- Standard SMILES
O=[N+]([O-])c1ccccc1Sc1cccc2cccnc12- InChIKey
XPVQGPSCMSYAPM-UHFFFAOYSA-N- Molecular formula
- C15H10N2O2S
- Average molar mass
- 282.3 g/mol
- Monoisotopic mass
- 282.04629874
Names & identifiers
- Preferred name
- 8-(2-Nitrophenyl)sulfanylquinoline
- IUPAC
- 8-(2-nitrophenyl)sulfanylquinoline
Names & synonyms
8-(2-nitrophenyl)sulfanylquinoline8-(2-Nitro-phenylsulfanyl)-quinolineOprea1_190209Oprea1_602879SMSSF-06259691-nitro-2-(8-quinolylthio)benzeneAKOS001022158AMS_CNC_ID-245892998ST45016267ST50428101Z56755230
Database identifiers
- CAS
107916-45-0- PubChem CID
- 815586
- EC Number
- 158-639-7
Properties
Computed structural properties
- XLogP
- 4.1
- Topological polar surface area
- 84 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 2
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 347
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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