Cas no 606931-02-6 (1-Boc-4-(2-chloroethyl)homopiperazine)

1-Boc-4-(2-chloroethyl)homopiperazine structure
606931-02-6 structure
Product Name:1-Boc-4-(2-chloroethyl)homopiperazine
CAS No:606931-02-6
MF:C12H23ClN2O2
MW:262.776222467422
CID:2951127
PubChem ID:114293370
Update Time:2024-11-04

1-Boc-4-(2-chloroethyl)homopiperazine Chemical and Physical Properties

Names and Identifiers

    • 1-BOC-4-(2-氯乙基)高哌嗪
    • 1-Boc-4-(2-chloroethyl)homopiperazine
    • TERT-BUTYL 4-(2-CHLOROETHYL)-1,4-DIAZEPANE-1-CARBOXYLATE
    • starbld0010838
    • 606931-02-6
    • MDL: MFCD24161559
    • Inchi: 1S/C12H23ClN2O2/c1-12(2,3)17-11(16)15-7-4-6-14(8-5-13)9-10-15/h4-10H2,1-3H3
    • InChI Key: PUWCOZCPGPDIRC-UHFFFAOYSA-N
    • SMILES: ClCCN1CCN(C(=O)OC(C)(C)C)CCC1

Computed Properties

  • Exact Mass: 262.1448057 g/mol
  • Monoisotopic Mass: 262.1448057 g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 17
  • Rotatable Bond Count: 4
  • Complexity: 253
  • 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
  • Molecular Weight: 262.77
  • XLogP3: 1.9
  • Topological Polar Surface Area: 32.8
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