Benzene, 1,4-dimethyl-2-[(4-methylphenyl)sulfonyl]-
Basic information
- CAS
1816-96-2- Standard SMILES
Cc1ccc(S(=O)(=O)c2cc(C)ccc2C)cc1- InChIKey
GKNGBKLNJPDXGS-UHFFFAOYSA-N- Molecular formula
- C15H16O2S
- Average molar mass
- 260.4 g/mol
- Monoisotopic mass
- 260.08710092
Names & identifiers
- Preferred name
- Benzene, 1,4-dimethyl-2-[(4-methylphenyl)sulfonyl]-
- IUPAC
- 1,4-dimethyl-2-(4-methylphenyl)sulfonylbenzene
- English name
- 2,5-Dimethylphenyl(4-methylphenyl) sulfone
- Molecular formula
- C15H16O2S
- Molecular weight
- 260.35
Names & synonyms
1816-96-21,4-Dimethyl-2-((4-methylphenyl)sulfonyl)benzene1,4-dimethyl-2-[(4-methylphenyl)sulfonyl]benzeneBenzene, 1,4-dimethyl-2-((4-methylphenyl)sulfonyl)-Benzene, 1,4-dimethyl-2-[(4-methylphenyl)sulfonyl]-RefChem:5623332-(p-Tolyl-2,5-xylylsulfone)2,5-Dimethylphenyl(4-methylphenyl) sulfone1,4-Dimethyl-2-(4-methylbenzene-1-sulfonyl)benzene1,4-dimethyl-2-(4-methylphenyl)sulfonylbenzeneOprea1_322214IFLab1_001260
Show more names
(2,5-Dimethylphenyl)p-tolyl sulfone2,5-Dimethylphenyl(p-tolyl) sulfone2,5-Dimethylphenyl 4-methylphenyl sulfone4-Methylphenyl(2,5-dimethylphenyl) sulfone(2,5-Dimethylphenyl)(4-methylphenyl) sulfone
1,4-DIMETHYL-2-(4-METHYLBENZENESULFONYL)BENZENEDTXSID1061990SCHEMBL11127859GKNGBKLNJPDXGS-UHFFFAOYSA-N2,5,4'-trimethyldiphenyl sulfoneHMS1415J06MFCD00434142AKOS001584814
Database identifiers
- CAS
1816-96-2- PubChem CID
- 74553
- DTXSID
DTXSID1061990- Nikkaji
- J31.916C
Properties
Computed structural properties
- XLogP
- 3.8
- Topological polar surface area
- 42.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 360
Physicochemical properties
- Melting point
- 107 · 107-109 °C
- Boiling point
- 421.749 · 421.749±44.00 °C(Press: 760.00 Torr)(predicted)
- Density
- 1.149 · 1.149±0.06 g/cm3(Temp: 25 °C; Press: 760 Torr)(predicted)
- EPA Substance Registry System
- 2 · 2-(p-Tolyl-2,5-xylylsulfone) (1816-96-2)
- TSCA
- TSCA listed
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- tsca
- TSCA listed
Chemistry & industry
Uses & manufacturing
General Manufacturing InformationBenzene, 1,4-dimethyl-2-[(4-methylphenyl)sulfonyl]-: INACTIVE
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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