Cas no 80481-96-5 (Cyclopentane-1,1-dicarboxylic acid)

Cyclopentane-1,1-dicarboxylic acid structure
80481-96-5 structure
Product Name:Cyclopentane-1,1-dicarboxylic acid
CAS No:80481-96-5
MF:C7H10O4
MW:158.151902675629
CID:2724335
PubChem ID:228895
Update Time:2025-04-21

Cyclopentane-1,1-dicarboxylic acid Chemical and Physical Properties

Names and Identifiers

    • 1,1-Cyclopentanedicarboxylicacid
    • MFCD00029146
    • NSC22076
    • DTXSID80901708
    • MLS002638841
    • SCHEMBL440358
    • NSC-22076
    • AKOS016011116
    • 5802-65-3
    • Cyclopentanedicarboxylic acid
    • NoName_846
    • cyclopentane-1,1-dicarboxylic acid
    • SY047782
    • DA-30478
    • HMS3082E21
    • 1,1-Cyclopentanedicarboxylic acid
    • SMR001548303
    • DS-6415
    • 80481-96-5
    • CS-0043922
    • Cyclopentane-1,1-dicarboxylic acid
    • Inchi: 1S/C7H10O4/c8-5(9)7(6(10)11)3-1-2-4-7/h1-4H2,(H,8,9)(H,10,11)
    • InChI Key: YZFOGXKZTWZVFN-UHFFFAOYSA-N
    • SMILES: OC(C1(C(=O)O)CCCC1)=O

Computed Properties

  • Exact Mass: 158.05790880Da
  • Monoisotopic Mass: 158.05790880Da
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 2
  • Hydrogen Bond Acceptor Count: 4
  • Heavy Atom Count: 11
  • Rotatable Bond Count: 2
  • Complexity: 175
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: 0.9
  • Topological Polar Surface Area: 74.6?2
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