Cas no 92984-49-1 (methyl 2-cycloheptylideneacetate)

methyl 2-cycloheptylideneacetate structure
92984-49-1 structure
Product Name:methyl 2-cycloheptylideneacetate
CAS No:92984-49-1
MF:C10H16O2
MW:168.232843399048
CID:801096
PubChem ID:7006658
Update Time:2025-04-19

methyl 2-cycloheptylideneacetate Chemical and Physical Properties

Names and Identifiers

    • Acetic acid,2-cycloheptylidene-, methyl ester
    • methyl 2-cycloheptylideneacetate
    • cycloheptyliden-acetic acid methyl ester
    • Cycloheptyliden-essigsaeure-methylester
    • methyl cycloheptylidene acetate
    • EN300-100893
    • SCHEMBL8089816
    • DTXSID90426518
    • methyl2-cycloheptylideneacetate
    • 92984-49-1
    • FT-0628719
    • METHYL CYCLOHEPTYLIDENEACETATE
    • AKOS023590278
    • Inchi: 1S/C10H16O2/c1-12-10(11)8-9-6-4-2-3-5-7-9/h8H,2-7H2,1H3
    • InChI Key: BQKJZAQJFOUASE-UHFFFAOYSA-N
    • SMILES: O(C)C(/C=C1/CCCCCC/1)=O

Computed Properties

  • Exact Mass: 168.11500
  • Monoisotopic Mass: 168.115029749g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 12
  • Rotatable Bond Count: 2
  • Complexity: 172
  • 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: 2.7
  • Topological Polar Surface Area: 26.3?2

Experimental Properties

  • Density: 1.042
  • Boiling Point: 100°C 6mm
  • Flash Point: 115.2°C
  • Refractive Index: 1.526
  • PSA: 26.30000
  • LogP: 2.44000

methyl 2-cycloheptylideneacetate Security Information

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