Cas no 87390-36-1 (1,3a,6a-Trimethyloctahydrocyclopenta[b]pyrrole)

1,3a,6a-Trimethyloctahydrocyclopenta[b]pyrrole structure
87390-36-1 structure
Product Name:1,3a,6a-Trimethyloctahydrocyclopenta[b]pyrrole
CAS No:87390-36-1
MF:C10H19N
MW:153.26456284523
CID:656861
PubChem ID:20157785
Update Time:2024-03-01

1,3a,6a-Trimethyloctahydrocyclopenta[b]pyrrole Chemical and Physical Properties

Names and Identifiers

    • Cyclopenta[b]pyrrole, octahydro-1,3a,6a-trimethyl-
    • 1,3a,6a-trimethyl-3,4,5,6-tetrahydro-2H-cyclopenta[b]pyrrole
    • 1,3a,6a-Trimethyloctahydrocyclopenta[b]pyrrole
    • Inchi: 1S/C10H19N/c1-9-5-4-6-10(9,2)11(3)8-7-9/h4-8H2,1-3H3
    • InChI Key: JTWDSKVWODSEPF-UHFFFAOYSA-N
    • SMILES: N1(C)CCC2(C)CCCC12C

Computed Properties

  • Exact Mass: 153.151749610g/mol
  • Monoisotopic Mass: 153.151749610g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 1
  • Heavy Atom Count: 11
  • Rotatable Bond Count: 0
  • Complexity: 178
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 2
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • Topological Polar Surface Area: 3.2
  • XLogP3: 2.1
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