Cas no 7086-29-5 (1-Phenylcycloheptane-1-carboxylic acid)

1-Phenylcycloheptane-1-carboxylic acid structure
7086-29-5 structure
Product Name:1-Phenylcycloheptane-1-carboxylic acid
CAS No:7086-29-5
MF:C14H18O2
MW:218.291524410248
MDL:MFCD11188900
CID:2139246
PubChem ID:28937723
Update Time:2024-03-01

1-Phenylcycloheptane-1-carboxylic acid Chemical and Physical Properties

Names and Identifiers

    • 1-phenyl-1-cycloheptanecarboxylic acid
    • 1-phenylcycloheptane-1-carboxylic acid
    • DEFBPPYKOPTXIJ-UHFFFAOYSA-N
    • 1-Phenylcycloheptanecarboxylic acid
    • 1-Phenyl-cycloheptanecarboxylic acid
    • Z2681277164
    • 1-Phenylcycloheptane-1-carboxylic acid
    • MDL: MFCD11188900
    • Inchi: 1S/C14H18O2/c15-13(16)14(10-6-1-2-7-11-14)12-8-4-3-5-9-12/h3-5,8-9H,1-2,6-7,10-11H2,(H,15,16)
    • InChI Key: DEFBPPYKOPTXIJ-UHFFFAOYSA-N
    • SMILES: OC(C1(C2C=CC=CC=2)CCCCCC1)=O

Computed Properties

  • Exact Mass: 218.130679813g/mol
  • Monoisotopic Mass: 218.130679813g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 16
  • Rotatable Bond Count: 2
  • Complexity: 233
  • 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
  • Topological Polar Surface Area: 37.3
  • XLogP3: 3.9

1-Phenylcycloheptane-1-carboxylic acid Security Information

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Related Categories No. Product Name Cas No. Purity Specification Price update time Inquiry
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