Cas no 59057-35-1 (Benzenesulfinicacid, 2,4,6-trimethyl-)

Benzenesulfinicacid, 2,4,6-trimethyl- structure
59057-35-1 structure
Product Name:Benzenesulfinicacid, 2,4,6-trimethyl-
CAS No:59057-35-1
MF:C9H12O2S
MW:184.255381584167
CID:386170
PubChem ID:313678
Update Time:2025-09-18

Benzenesulfinicacid, 2,4,6-trimethyl- Chemical and Physical Properties

Names and Identifiers

    • Benzenesulfinicacid, 2,4,6-trimethyl-
    • 2,4,6-trimethylbenzenesulfinic acid
    • 2,4,6-trimethyl-benzenesulfinic acid
    • 2,4,6-trimethylbenzenesulphinic acid
    • 2,4,6-Trimethyl-benzolsulfinsaeure
    • AC1L7NYW
    • CTK1H4881
    • Mesitylen-eso-sulfinsaeure
    • mesitylenesulfinic acid
    • Mesitylensulfinsaeure
    • NCIOpen2_002914
    • NSC229317
    • SureCN345129
    • AKOS022536468
    • SCHEMBL345129
    • 59057-35-1
    • DTXSID50310601
    • SCHEMBL12856118
    • NSC-229317
    • 2,4,6-trimethylbenzenesulfinicacid
    • CS-0205191
    • Inchi: 1S/C9H12O2S/c1-6-4-7(2)9(12(10)11)8(3)5-6/h4-5H,1-3H3,(H,10,11)
    • InChI Key: CGRMGOGJWHPCFJ-UHFFFAOYSA-N
    • SMILES: S(C1C(C)=CC(C)=CC=1C)(=O)O

Computed Properties

  • Exact Mass: 184.05586
  • Monoisotopic Mass: 184.056
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 12
  • Rotatable Bond Count: 1
  • Complexity: 169
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: 2.2
  • Topological Polar Surface Area: 56.5?2

Experimental Properties

  • Density: 1.26
  • Boiling Point: 363.4°Cat760mmHg
  • Flash Point: 173.6°C
  • Refractive Index: 1.615
  • PSA: 37.3
  • LogP: 3.05810

Benzenesulfinicacid, 2,4,6-trimethyl- Pricemore >>

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