Cas no 773873-23-7 (4-(Methylsulphonyl)-2-nitrobenzyl Alcohol)

4-(Methylsulphonyl)-2-nitrobenzyl Alcohol structure
773873-23-7 structure
Product Name:4-(Methylsulphonyl)-2-nitrobenzyl Alcohol
CAS No:773873-23-7
MF:C8H9NO5S
MW:231.225761175156
CID:1074909
PubChem ID:45026863
Update Time:2025-09-28

4-(Methylsulphonyl)-2-nitrobenzyl Alcohol Chemical and Physical Properties

Names and Identifiers

    • [4-(Methylsulfonyl)-2-nitrophenyl]methanol
    • CS-0357231
    • YFB87323
    • 773873-23-7
    • (4-methylsulfonyl-2-nitrophenyl)methanol
    • (4-(Methylsulfonyl)-2-nitrophenyl)methanol
    • MFCD06203102
    • 4-(Methylsulphonyl)-2-nitrobenzyl Alcohol
    • MDL: MFCD06203102
    • Inchi: 1S/C8H9NO5S/c1-15(13,14)7-3-2-6(5-10)8(4-7)9(11)12/h2-4,10H,5H2,1H3
    • InChI Key: XDJPKTPTLIVLDS-UHFFFAOYSA-N
    • SMILES: S(C)(C1C=CC(CO)=C(C=1)[N+](=O)[O-])(=O)=O

Computed Properties

  • Exact Mass: 231.02014356g/mol
  • Monoisotopic Mass: 231.02014356g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 15
  • Rotatable Bond Count: 3
  • Complexity: 328
  • 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: 0.1
  • Topological Polar Surface Area: 109?2

4-(Methylsulphonyl)-2-nitrobenzyl Alcohol Security Information

  • HazardClass:IRRITANT

4-(Methylsulphonyl)-2-nitrobenzyl Alcohol Pricemore >>

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