4-Methylsulfonyl-N-phenylbenzenamine
Basic information
- CAS
15979-81-4- Standard SMILES
CS(=O)(=O)c1ccc(Nc2ccccc2)cc1- InChIKey
BKQHFWRWUNOUCR-UHFFFAOYSA-N- Molecular formula
- C13H13NO2S
- Average molar mass
- 247.31 g/mol
- Monoisotopic mass
- 247.06669983
Names & identifiers
- Preferred name
- 4-Methylsulfonyl-N-phenylbenzenamine
- IUPAC
- 4-methylsulfonyl-N-phenylaniline
Names & synonyms
4-METHYLSULFONYL-N-PHENYLBENZENAMINE15979-81-4DTXSID50166726RefChem:294697DTXCID1089217SCHEMBL3245767SCHEMBL54579844-(Methanesulfonyl)-N-phenylaniline
Database identifiers
- CAS
15979-81-4- PubChem CID
- 27592
- DTXSID
DTXSID50166726- Nikkaji
- J1.557.032F
Properties
Computed structural properties
- XLogP
- 2
- Topological polar surface area
- 54.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 320
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Related reactions
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Compound notes
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