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Lactoyl-CoA Triclocarban 133-53-9 88-04-0 β-Fructofuranosidase
  1. chem960
  2. 5368-21-8
4-ethyl-3-phenylpiperazin-2-one | 5368-21-8
5368-21-8

Product name：4-ethyl-3-phenylpiperazin-2-one

CAS No：5368-21-8
MF：C12H16N2O
MW：204.26824
CID：1584052
PubChem ID：250677
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Names and Identifiers
  • 4-ethyl-3-phenylpiperazin-2-one
  • NSC70396
  • AC1Q6GXO
  • AC1L5I72
  • CTK4J8597
  • AR-1G2229
  • NSC-70396
  • AG-J-27985
  • NSC70396
  • AC1Q6GXO
  • AC1L5I72
  • CTK4J8597
  • AR-1G2229
  • NSC-70396
  • AG-J-27985
  • NSC 70396
  • NSC 70396
  • DTXSID00290686
  • DTXSID00290686
  • 5368-21-8
  • 5368-21-8
  • InChIKey：JYFJCYPPWYOCEC-UHFFFAOYSA-N
  • InChIKey：JYFJCYPPWYOCEC-UHFFFAOYSA-N
  • InChIKey：JYFJCYPPWYOCEC-UHFFFAOYSA-N
  • Inchi：InChI=1S/C12H16N2O/c1-2-14-9-8-13-12(15)11(14)10-6-4-3-5-7-10/h3-7,11H,2,8-9H2,1H3,(H,13,15)
  • Inchi：InChI=1S/C12H16N2O/c1-2-14-9-8-13-12(15)11(14)10-6-4-3-5-7-10/h3-7,11H,2,8-9H2,1H3,(H,13,15)
  • Inchi：InChI=1S/C12H16N2O/c1-2-14-9-8-13-12(15)11(14)10-6-4-3-5-7-10/h3-7,11H,2,8-9H2,1H3,(H,13,15)
  • SMILES：CCN1CCNC(=O)C1C2=CC=CC=C2
  • SMILES：CCN1CCNC(=O)C1C2=CC=CC=C2
  • SMILES：CCN1CCNC(=O)C1C2=CC=CC=C2
Chemical and Physical Properties

Computed Properties

  • Exact Mass: 204.12638
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 2
  • Rotatable Bond Count: 2
  • Monoisotopic Mass: 204.126
  • Heavy Atom Count: 15
  • Complexity: 224
  • Isotope Atom Count: 0
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 1
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • Covalently-Bonded Unit Count: 1
  • XLogP3: 1.4
  • XLogP3: 1.4
  • XLogP3: 1.4
  • Topological Polar Surface Area: 32.3Ų
  • Topological Polar Surface Area: 32.3Ų
  • Topological Polar Surface Area: 32.3Ų

Experimental Properties

  • LogP: 1.44610
  • PSA: 32.34
  • Refractive Index: 1.53
  • Boiling Point: 378.2°C at 760 mmHg
  • Flash Point: 182.5°C
  • Density: 1.064
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