Cas no 91912-54-8 (1-Iodo-4-(methoxymethyl)benzene)

1-Iodo-4-(methoxymethyl)benzene structure
91912-54-8 structure
Product Name:1-Iodo-4-(methoxymethyl)benzene
CAS No:91912-54-8
MF:C8H9IO
MW:248.060934782028
CID:94123
PubChem ID:13796873
Update Time:2025-04-18

1-Iodo-4-(methoxymethyl)benzene Chemical and Physical Properties

Names and Identifiers

    • 1-Iodo-4-(methoxymethyl)benzene
    • (4-Iod-benzyl)-methyl-ether
    • 1-Iod-4-methoxymethyl-benzol
    • Benzene,1-iodo-4-(methoxymethyl)
    • Benzene, 1-iodo-4-(methoxymethyl)-
    • 4-(Methoxymethyl)phenyl iodide
    • 4-Iodobenzyl alcohol, methyl ether
    • 912I548
    • DCQYAEJVEBYSTJ-UHFFFAOYSA-N
    • SCHEMBL514658
    • DTXSID50549752
    • EN300-646102
    • CS-0253518
    • 91912-54-8
    • AKOS014829595
    • FT-0762428
    • Inchi: 1S/C8H9IO/c1-10-6-7-2-4-8(9)5-3-7/h2-5H,6H2,1H3
    • InChI Key: DCQYAEJVEBYSTJ-UHFFFAOYSA-N
    • SMILES: IC1C=CC(=CC=1)COC

Computed Properties

  • Exact Mass: 247.97000
  • Monoisotopic Mass: 247.96981g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 1
  • Heavy Atom Count: 10
  • Rotatable Bond Count: 2
  • Complexity: 87.3
  • 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: 9.2

Experimental Properties

  • Density: 1.646
  • Boiling Point: 222.4 °C at 760 mmHg
  • Flash Point: 88.3 °C
  • PSA: 9.23000
  • LogP: 2.43760

1-Iodo-4-(methoxymethyl)benzene Pricemore >>

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