Cas no 10407-33-7 (Methyl 3-(2-oxocyclohexyl)propanoate)

Methyl 3-(2-oxocyclohexyl)propanoate structure
10407-33-7 structure
Product Name:Methyl 3-(2-oxocyclohexyl)propanoate
CAS No:10407-33-7
MF:C10H16O3
MW:184.232243537903
CID:1147374
PubChem ID:112036
Update Time:2025-04-20

Methyl 3-(2-oxocyclohexyl)propanoate Chemical and Physical Properties

Names and Identifiers

    • methyl 3-(2-oxocyclohexyl)propanoate
    • methyl 3-(2-oxo-cyclohexyl)propanoate
    • 3-(2-Oxo-cyclohexyl)-propionsaeure-methylester
    • CTK0G6616
    • Methyl 3-(2-oxocyclohexan-1-yl)propionate
    • Methyl 2-oxocyclohexanepropionate
    • 3-(2-oxo-cyclohexyl)-propionic acid methyl ester
    • STOCK1S-04821
    • SureCN8159406
    • Cyclohexanepropanoic acid, 2-oxo-, methyl ester
    • 3-(2-oxocyclohexyl)propanoic acid methyl ester
    • HMS1578P12
    • methyl 3-(2-oxo-cyclohexyl)propionate
    • AC1L3AL1
    • Methyl 2-oxocyclohexane-3-propionate
    • Methyl 2-oxocyclohexane-3-
    • Methyl 3-(2-oxocyclohexyl)propionate
    • Methyl 3-(2-oxocyclohexyl)propanoate #
    • DA-16022
    • DTXSID70884470
    • 10407-33-7
    • 2-(2-methoxycarbonyl-ethyl) cyclohexanone
    • STL450891
    • AI3-28143
    • SCHEMBL8159406
    • AKOS022358660
    • Methyl 3-(2-oxocyclohexyl)propanoate
    • Inchi： 1S/C10H16O3/c1-13-10(12)7-6-8-4-2-3-5-9(8)11/h8H,2-7H2,1H3
    • InChI Key： NYUXNQYPEPSSAT-UHFFFAOYSA-N
    • SMILES： O=C1CCCCC1CCC(=O)OC

Computed Properties

  • Exact Mass: 184.11
  • Monoisotopic Mass: 184.11
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 13
  • Rotatable Bond Count: 4
  • Complexity: 198
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 1
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: 1.2
  • Topological Polar Surface Area: 43.4?2

Experimental Properties

  • Density: 1.04g/cm3
  • Boiling Point: 265.5oC at 760 mmHg
  • Flash Point: 111.8°C
  • Refractive Index: 1.456
  • LogP: 1.69890

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