Cas no 849035-77-4 (4-Bromo-2-(methylsulfonyl)benzaldehyde)

4-Bromo-2-(methylsulfonyl)benzaldehyde structure
849035-77-4 structure
Product Name:4-Bromo-2-(methylsulfonyl)benzaldehyde
CAS No:849035-77-4
MF:C8H7BrO3S
MW:263.108380556107
MDL:MFCD04037947
CID:716636
PubChem ID:2761076
Update Time:2025-04-19

4-Bromo-2-(methylsulfonyl)benzaldehyde Chemical and Physical Properties

Names and Identifiers

    • 4-Bromo-2-(methylsulfonyl)benzaldehyde
    • 4-BROMO-2-(METHYLSULPHONYL)BENZALDEHYDE
    • Benzaldehyde,4-bromo-2-(methylsulfonyl)-
    • Benzaldehyde, 4-bromo-2-(methylsulfonyl)-
    • 4-bromo-2-methylsulfonylbenzaldehyde
    • 4-bromo-2-methanesulfonylbenzaldehyde
    • KMXMXSSAUZKLCE-UHFFFAOYSA-N
    • OR7961
    • SBB102625
    • KM2253
    • 3101AC
    • 4-bromo-2-methansulfonyl-benzaldehyde
    • FCH1320912
    • TRA0041375
    • 4-bromo-2-(methylsulfonyl)benz-aldehyde
    • SY006887
    • Benzal
    • 4-Bromo-2-(methylsulfonyl)benzaldehyde, AldrichCPR
    • ZIB03577
    • DB-076163
    • MFCD04037947
    • 849035-77-4
    • PS-6002
    • SCHEMBL1793926
    • AKOS015835446
    • DTXSID40375527
    • MDL: MFCD04037947
    • Inchi: 1S/C8H7BrO3S/c1-13(11,12)8-4-7(9)3-2-6(8)5-10/h2-5H,1H3
    • InChI Key: KMXMXSSAUZKLCE-UHFFFAOYSA-N
    • SMILES: BrC1C=CC(C=O)=C(C=1)S(C)(=O)=O

Computed Properties

  • Exact Mass: 261.92993g/mol
  • Monoisotopic Mass: 261.92993g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 13
  • Rotatable Bond Count: 2
  • Complexity: 280
  • 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
  • Topological Polar Surface Area: 59.6
  • XLogP3: 1.3

Experimental Properties

  • PSA: 59.59000
  • LogP: 2.74590

4-Bromo-2-(methylsulfonyl)benzaldehyde Pricemore >>

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