Cas no 164203-45-6 (2-Buten-1-ol, 2-ethyl-4-[(1S)-2,2,3-trimethyl-3-cyclopenten-1-yl]-, (2E)-)

2-Buten-1-ol, 2-ethyl-4-[(1S)-2,2,3-trimethyl-3-cyclopenten-1-yl]-, (2E)- structure
164203-45-6 structure
Product Name:2-Buten-1-ol, 2-ethyl-4-[(1S)-2,2,3-trimethyl-3-cyclopenten-1-yl]-, (2E)-
CAS No:164203-45-6
MF:C14H24O
MW:208.339764595032
CID:1348279
PubChem ID:8030023
Update Time:2025-04-20

2-Buten-1-ol, 2-ethyl-4-[(1S)-2,2,3-trimethyl-3-cyclopenten-1-yl]-, (2E)- Chemical and Physical Properties

Names and Identifiers

    • 2-Buten-1-ol, 2-ethyl-4-[(1S)-2,2,3-trimethyl-3-cyclopenten-1-yl]-, (2E)-
    • KHQDWCKZXLWDNM-WHGQRRHOSA-N
    • L34AMW24TJ
    • SCHEMBL4971474
    • (e)-(s)-2-ethyl-4-(2,2,3-trimethylcyclopent-3-en-1-yl)-2-buten-1-ol
    • (E)-(S)-2-Ethyl-4-(2,2,3-trimethylcyclopent-3-en-1yl)-2-buten-1-ol
    • 2-Buten-1-ol, 2-ethyl-4-((1S)-2,2,3-trimethyl-3-cyclopenten-1-yl)-, (2E)-
    • 2-Ethyl-4-(2,2,3-trimethylcyclopent-3-en-1-yl)but-2-en-1-ol, (S-(E))-
    • 2-Buten-1-ol, 2-ethyl-4-(2,2,3-trimethyl-3-cyclopenten-1-yl)-, (S-(E))-
    • UNII-L34AMW24TJ
    • 164203-45-6
    • Inchi： 1S/C14H24O/c1-5-12(10-15)7-9-13-8-6-11(2)14(13,3)4/h6-7,13,15H,5,8-10H2,1-4H3/b12-7+/t13-/m0/s1
    • InChI Key： KHQDWCKZXLWDNM-WHGQRRHOSA-N
    • SMILES： OC/C(/CC)=C/C[C@@H]1CC=C(C)C1(C)C

Computed Properties

  • Exact Mass: 208.18282
  • Monoisotopic Mass: 208.182715385g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 1
  • Heavy Atom Count: 15
  • Rotatable Bond Count: 4
  • Complexity: 271
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 1
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 1
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: 3.6
  • Topological Polar Surface Area: 20.2?2

Experimental Properties

  • PSA: 20.23

2-Buten-1-ol, 2-ethyl-4-[(1S)-2,2,3-trimethyl-3-cyclopenten-1-yl]-, (2E)- Related Literature

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