Cas no 62691-05-8 (12-Methyl tetradecanoic acid methyl ester)

12-Methyl tetradecanoic acid methyl ester structure
62691-05-8 structure
Product Name:12-Methyl tetradecanoic acid methyl ester
CAS No:62691-05-8
MF:C16H32O2
MW:256.424085617065
CID:2035116
PubChem ID:23618376
Update Time:2025-04-21

12-Methyl tetradecanoic acid methyl ester Chemical and Physical Properties

Names and Identifiers

    • 12-Methyl tetradecanoic acid methyl ester
    • 12-methyl-tetradecanoic acid methyl ester
    • 12-Methyl-tetradecansaeure-methylester
    • 12-Methyltetradecansaeure-methylester
    • 12-Methyltetradecansaeuremethylester
    • 3-Methyl-tetradecansaeure-methylester
    • methyl 12-methyltetradecanoate
    • (S)-12-Methyltetradecanoic acid methyl ester
    • DB-344906
    • (S)-12-METHYLMETHY TETRADECANOIC ESTER
    • 62691-05-8
    • DTXSID201016014
    • Inchi: 1S/C16H32O2/c1-4-15(2)13-11-9-7-5-6-8-10-12-14-16(17)18-3/h15H,4-14H2,1-3H3
    • InChI Key: BJIUDNXPLSJWKE-UHFFFAOYSA-N
    • SMILES: CCC(CCCCCCCCCCC(OC)=O)C

Computed Properties

  • Exact Mass: 256.24
  • Monoisotopic Mass: 256.24
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 18
  • Rotatable Bond Count: 13
  • Complexity: 190
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 1
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • Topological Polar Surface Area: 26.3A^2
  • XLogP3: 6.6
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