Cas no 58648-36-5 (1,3,4,6-Pentalenetetracarboxylic acid, octahydro-2,5-dioxo-,tetramethyl ester)

1,3,4,6-Pentalenetetracarboxylic acid, octahydro-2,5-dioxo-,tetramethyl ester structure
58648-36-5 structure
Product Name:1,3,4,6-Pentalenetetracarboxylic acid, octahydro-2,5-dioxo-,tetramethyl ester
CAS No:58648-36-5
MF:C16H18O10
MW:370.308125972748
CID:341360
PubChem ID:283933
Update Time:2025-04-19

1,3,4,6-Pentalenetetracarboxylic acid, octahydro-2,5-dioxo-,tetramethyl ester Chemical and Physical Properties

Names and Identifiers

    • 1,3,4,6-Pentalenetetracarboxylic acid, octahydro-2,5-dioxo-,tetramethyl ester
    • tetramethyl 2,5-dioxo-1,3,3a,4,6,6a-hexahydropentalene-1,3,4,6-tetracarboxylate
    • (cis)-tetramethyl bicyclo[3.3.0]octane-3,7-dioxo-2,4,6,8-tetracarboxylate
    • 1,3,4,6-Tetramethoxycarbonyl-cis-pentalandion-(2,5)
    • AC1L5ZQ9
    • AC1Q43V8
    • AC1Q5Z1F
    • CTK5A8642
    • NSC627691
    • SureCN9729217
    • Weiss tetraester
    • NSC-627691
    • 1,4,6-Pentalenetetracarboxylic acid, octahydro-2,5-dioxo-, tetramethyl ester
    • 1,3,4,6-Pentalenetetracarboxylic acid, octahydro-2,5-dioxo-, tetramethyl ester
    • tetramethyl 2,5-dioxooctahydro-1,3,4,6-pentalenetetracarboxylate
    • NSC-139201
    • SCHEMBL11957849
    • SCHEMBL11359745
    • NSC139201
    • 58648-36-5
    • SCHEMBL9729217
    • DTXSID60300836
    • 1,3,4,6-Pentalenetetracarboxylic acid der.
    • AKOS024323846
    • Inchi： 1S/C16H18O10/c1-23-13(19)7-5-6(9(11(7)17)15(21)25-3)10(16(22)26-4)12(18)8(5)14(20)24-2/h5-10H,1-4H3
    • InChI Key： SWCWCPQCKMRHID-UHFFFAOYSA-N
    • SMILES： O=C1C(C(=O)OC)C2C(C(=O)OC)C(C(C(=O)OC)C2C1C(=O)OC)=O

Computed Properties

  • Exact Mass: 370.08994
  • Monoisotopic Mass: 370.08999677g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 10
  • Heavy Atom Count: 26
  • Rotatable Bond Count: 8
  • Complexity: 571
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 4
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: 0.1
  • Topological Polar Surface Area: 139?2

Experimental Properties

  • PSA: 139.34
  • LogP: -1.45900

1,3,4,6-Pentalenetetracarboxylic acid, octahydro-2,5-dioxo-,tetramethyl ester Related Literature

58648-36-5 (1,3,4,6-Pentalenetetracarboxylic acid, octahydro-2,5-dioxo-,tetramethyl ester) Related Products

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