Cas no 103604-33-7 (Butanoic acid, 4-chloro-, cycloheptyl ester)

Butanoic acid, 4-chloro-, cycloheptyl ester structure
103604-33-7 structure
Product Name:Butanoic acid, 4-chloro-, cycloheptyl ester
CAS No:103604-33-7
MF:C11H19ClO2
MW:218.720362901688
CID:1141524
Update Time:2024-07-27

Butanoic acid, 4-chloro-, cycloheptyl ester Chemical and Physical Properties

Names and Identifiers

    • Butanoic acid, 4-chloro-, cycloheptyl ester
    • Inchi: 1S/C11H19ClO2/c12-9-5-8-11(13)14-10-6-3-1-2-4-7-10/h10H,1-9H2
    • InChI Key: ABNPFTRKTOEWNB-UHFFFAOYSA-N
    • SMILES: C(OC1CCCCCC1)(=O)CCCCl

Computed Properties

  • Exact Mass: 218.10747

Experimental Properties

  • Density: 1.05±0.1 g/cm3(Predicted)
  • Boiling Point: 291.6±13.0 °C(Predicted)
  • PSA: 26.3
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