Cas no 106336-36-1 (1,2-Pentanediol, 5-(4-chlorophenyl)-)

1,2-Pentanediol, 5-(4-chlorophenyl)- structure
106336-36-1 structure
Product Name:1,2-Pentanediol, 5-(4-chlorophenyl)-
CAS No:106336-36-1
MF:C11H15ClO2
MW:214.688602685928
CID:1176764
Update Time:2024-08-05

1,2-Pentanediol, 5-(4-chlorophenyl)- Chemical and Physical Properties

Names and Identifiers

    • 1,2-Pentanediol, 5-(4-chlorophenyl)-
    • Inchi: 1S/C11H15ClO2/c12-10-6-4-9(5-7-10)2-1-3-11(14)8-13/h4-7,11,13-14H,1-3,8H2
    • InChI Key: JEYZSNIKKIHEBL-UHFFFAOYSA-N
    • SMILES: C(O)C(O)CCCC1=CC=C(Cl)C=C1

Computed Properties

  • Exact Mass: 214.07615

Experimental Properties

  • Density: 1.198±0.06 g/cm3(Predicted)
  • Boiling Point: 360.6±32.0 °C(Predicted)
  • PSA: 40.46
  • pka: 14.39±0.20(Predicted)
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