Cas no 700802-76-2 (4-(4-Isopropylpiperazin-1-yl)benzoic acid)

4-(4-Isopropylpiperazin-1-yl)benzoic acid structure
700802-76-2 structure
Product Name:4-(4-Isopropylpiperazin-1-yl)benzoic acid
CAS No:700802-76-2
MF:C14H20N2O2
MW:248.320803642273
CID:859318
Update Time:2023-08-02

4-(4-Isopropylpiperazin-1-yl)benzoic acid Chemical and Physical Properties

Names and Identifiers

    • 4-(4-Isopropylpiperazin-1-yl)benzoic acid
    • 4-[4-(1-methylethyl)-1-piperazinyl]Benzoic acid
    • TVFABCRYJXZFKI-UHFFFAOYSA-N
    • Inchi: 1S/C14H20N2O2/c1-11(2)15-7-9-16(10-8-15)13-5-3-12(4-6-13)14(17)18/h3-6,11H,7-10H2,1-2H3,(H,17,18)
    • InChI Key: TVFABCRYJXZFKI-UHFFFAOYSA-N
    • SMILES: OC(C1C=CC(=CC=1)N1CCN(C(C)C)CC1)=O

Computed Properties

  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 4
  • Heavy Atom Count: 18
  • Rotatable Bond Count: 3
  • Complexity: 278
  • Topological Polar Surface Area: 43.8

4-(4-Isopropylpiperazin-1-yl)benzoic acid Pricemore >>

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