Cas no 70492-74-9 (1-Naphthalenepentanoic acid, 5-carboxy-1,2,3,4,4a,7,8,8a-octahydro-β,1,2,4a-tetramethyl-, (βS,1S,2R,4aR,8aR)-)

1-Naphthalenepentanoic acid, 5-carboxy-1,2,3,4,4a,7,8,8a-octahydro-β,1,2,4a-tetramethyl-, (βS,1S,2R,4aR,8aR)- structure
70492-74-9 structure
Product Name:1-Naphthalenepentanoic acid, 5-carboxy-1,2,3,4,4a,7,8,8a-octahydro-β,1,2,4a-tetramethyl-, (βS,1S,2R,4aR,8aR)-
CAS No:70492-74-9
MF:C20H32O4
MW:336.465686798096
CID:574386
Update Time:2024-03-01

1-Naphthalenepentanoic acid, 5-carboxy-1,2,3,4,4a,7,8,8a-octahydro-β,1,2,4a-tetramethyl-, (βS,1S,2R,4aR,8aR)- Chemical and Physical Properties

Names and Identifiers

    • 1-Naphthalenepentanoicacid, 5-carboxy-1,2,3,4,4a,7,8,8a-octahydro-b,1,2,4a-tetramethyl-, (bS,1S,2R,4aR,8aR)-
    • 1-Naphthalenepentanoicacid, 5-carboxy-1,2,3,4,4a,7,8,8a-octahydro-b,1,2,4a-tetramethyl-, [1S-[1a(R*),2b,4ab,8aa]]-
    • Haplociliatic acid
    • 1-Naphthalenepentanoic acid, 5-carboxy-1,2,3,4,4a,7,8,8a-octahydro-β,1,2,4a-tetramethyl-, (βS,1S,2R,4aR,8aR)-
    • Inchi: 1S/C20H32O4/c1-13(12-17(21)22)8-10-19(3)14(2)9-11-20(4)15(18(23)24)6-5-7-16(19)20/h6,13-14,16H,5,7-12H2,1-4H3,(H,21,22)(H,23,24)
    • InChI Key: LGKWFTJHZPDXFD-UHFFFAOYSA-N
    • SMILES: CC(CC(=O)O)CCC1(C2CCC=C(C2(C)CCC1C)C(=O)O)C

Computed Properties

  • Hydrogen Bond Donor Count: 2
  • Hydrogen Bond Acceptor Count: 4
  • Heavy Atom Count: 24
  • XLogP3: 6.259
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