Cas no 42131-28-2 (Propanoic acid,2-hydroxy-, isooctadecyl ester)

Propanoic acid,2-hydroxy-, isooctadecyl ester structure
42131-28-2 structure
Product Name:Propanoic acid,2-hydroxy-, isooctadecyl ester
CAS No:42131-28-2
MF:C21H42O3
MW:342.556387424469
CID:329311
PubChem ID:6451828
Update Time:2025-04-19

Propanoic acid,2-hydroxy-, isooctadecyl ester Chemical and Physical Properties

Names and Identifiers

    • Propanoic acid,2-hydroxy-, isooctadecyl ester
    • 16-Methylheptadecyl 2-hydroxypropanoate
    • 2-Hydroxypropanoic acid, isostearyl ester
    • AC1O545B
    • AG-F-49801
    • CTK4I5739
    • EINECS 255-674-0
    • Isooctadecyl 2-hydroxypropanoate
    • Isooctadecyl lactate
    • Isostearyl lactate
    • UNII-8OM3O3YPML
    • NS00013800
    • Propanoic acid, 2-hydroxy-, isostearyl ester
    • DERMOL ISL
    • Propanoic acid, 2-hydroxy-, isooctadecyl ester
    • AEC ISOSTEARYL LACTATE
    • JEECHEM ISL
    • OH-ISOSTEARYL
    • SCHEMBL15264
    • Q27270826
    • DUB LIS
    • PELEMOL ISL
    • DTXSID70866079
    • 42131-28-2
    • 8OM3O3YPML
    • ISOSTEARYL LACTATE [INCI]
    • RITALAC IL
    • Inchi: 1S/C21H42O3/c1-19(2)17-15-13-11-9-7-5-4-6-8-10-12-14-16-18-24-21(23)20(3)22/h19-20,22H,4-18H2,1-3H3
    • InChI Key: RWKSBJVOQGKDFZ-UHFFFAOYSA-N
    • SMILES: O(C(C(C)O)=O)CCCCCCCCCCCCCCCC(C)C

Computed Properties

  • Exact Mass: 342.31339520g/mol
  • Monoisotopic Mass: 342.31339520g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 24
  • Rotatable Bond Count: 18
  • Complexity: 276
  • 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: 8.4
  • Topological Polar Surface Area: 46.5?2
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