Cas no 52156-51-1 (5-benzyl-3-(chloromethyl)-1,2,4-oxadiazole)

5-benzyl-3-(chloromethyl)-1,2,4-oxadiazole structure
52156-51-1 structure
Product Name:5-benzyl-3-(chloromethyl)-1,2,4-oxadiazole
CAS No:52156-51-1
MF:C10H9ClN2O
MW:208.64426112175
CID:360434
PubChem ID:12044213
Update Time:2025-04-19

5-benzyl-3-(chloromethyl)-1,2,4-oxadiazole Chemical and Physical Properties

Names and Identifiers

    • 1,2,4-Oxadiazole, 3-(chloromethyl)-5-(phenylmethyl)-
    • 5-benzyl-3-(chloromethyl)-1,2,4-oxadiazole
    • XECLIXXHUYTYJD-UHFFFAOYSA-N
    • AKOS005725255
    • DTXSID40476402
    • 52156-51-1
    • EN300-73638
    • CCA15651
    • 3-chloromethyl-5-benzyl-1,2,4-oxadiazole
    • SCHEMBL1695721
    • Inchi: 1S/C10H9ClN2O/c11-7-9-12-10(14-13-9)6-8-4-2-1-3-5-8/h1-5H,6-7H2
    • InChI Key: XECLIXXHUYTYJD-UHFFFAOYSA-N
    • SMILES: ClCC1=NOC(CC2C=CC=CC=2)=N1

Computed Properties

  • Exact Mass: 208.04047
  • Monoisotopic Mass: 208.0403406g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 14
  • Rotatable Bond Count: 3
  • Complexity: 174
  • 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: 2.5
  • Topological Polar Surface Area: 38.9?2

Experimental Properties

  • PSA: 38.92

5-benzyl-3-(chloromethyl)-1,2,4-oxadiazole Pricemore >>

Related Categories No. Product Name Cas No. Purity Specification Price update time Inquiry
TRC
B537198-25mg
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$ 50.00 2022-06-07
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A2B Chem LLC
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AV68155-100mg
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A2B Chem LLC
AV68155-250mg
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A2B Chem LLC
AV68155-500mg
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