chempirical

Methyl P-tolyl sulfone

C8H10O2SCAS 3185-99-7170.23 g/mol

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Sulfone

Properties

Molecular formula
C8H10O2S
Molar mass
170.23 g/mol
Exact mass
170.0402 Da
Melting point
89 °C
Boiling point
90 °C
logP
1.40Crippen estimate
Polar surface area
34.1 Ų
H-bond donors / acceptors
0 / 2
Rotatable bonds
1

Identifiers

CAS number
3185-99-7
SMILES
Cc1ccc(S(C)(=O)=O)cc1
InChIKey
YYDNBUBMBZRNQQ-UHFFFAOYSA-N
InChI
InChI=1S/C8H10O2S/c1-7-3-5-8(6-4-7)11(2,9)10/h3-6H,1-2H3

Weigh it out

Type any one amount. The others follow from the molar mass.

Names and synonyms

17 names · show all
  • Benzene, 1-methyl-4-(methylsulfonyl)-
  • Sulfone, methyl p-tolyl
  • 1-Methyl-4-(methylsulfonyl)benzene
  • p-Tolyl methyl sulfone
  • Methyl 4-methylphenyl sulfone
  • Methyl 4-tolyl sulfone
  • p-(Methylsulfonyl)toluene
  • (p-Tolylsulfonyl)methane
  • 4-Methylsulfonyltoluene
  • Methyl p-methylphenyl sulfone
  • NSC 2722
  • NSC 29038
  • 4-Methylphenyl methyl sulfone
  • 1-(Methylsulfonyl)-4-methylbenzene
  • 4-Methylsulfonyl-1-methylbenzene
  • 4-(Methanesulfonyl)toluene
  • 1-Methanesulfonyl-4-methylbenzene

Work with Methyl P-tolyl sulfone

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Boiling point under vacuumAt any pressure, from its normal boiling point Isotope patternExact mass and the mass spectrum pattern

Same formula

[(Methylsulfonyl)methyl]benzene3112-90-1 2-Thiophenebutanoic acid4653-11-6 Ethyl 2-thienylacetate57382-97-5 S-(2-Furanylmethyl) propanethioate59020-85-8 (Ethylsulfonyl)benzene599-70-2

Elsewhere

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