Cas no 1219804-81-5 (Methyl heptadecanoate-d)

Methyl heptadecanoate-d structure
Methyl heptadecanoate-d structure
Product Name:Methyl heptadecanoate-d
CAS No:1219804-81-5
MF:C18H36O2
MW:317.680582046509
CID:1058424
PubChem ID:329764791
Update Time:2025-04-20

Methyl heptadecanoate-d Chemical and Physical Properties

Names and Identifiers

    • Methyl heptadecanoate-d33
    • Methyl Margarate-d33
    • Heptadecanoic acid-d33 methyl ester
    • Methyl heptadecanoate-d
    • MS-24689
    • Methyl heptadecanoate-d33, analytical standard
    • CS-0226187
    • methyl 2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,11,12,12,13,13,14,14,15,15,16,16,17,17,17-tritriacontadeuterioheptadecanoate
    • Heptadecanoic Acid Ethyl Ester-d33
    • J-004743
    • DB-320090
    • HY-W004290S
    • D99243
    • Methyl (~2~H_33_)heptadecanoate
    • DTXSID30746000
    • 1219804-81-5
    • Methyl heptadecanoate-d33, 98 atom % D, 98% (CP)
    • MDL: MFCD03428281
    • Inchi: 1S/C18H36O2/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18(19)20-2/h3-17H2,1-2H3/i1D3,3D2,4D2,5D2,6D2,7D2,8D2,9D2,10D2,11D2,12D2,13D2,14D2,15D2,16D2,17D2
    • InChI Key: HUEBIMLTDXKIPR-SRIUXHGCSA-N
    • SMILES: O(C)C(C([2H])([2H])C([2H])([2H])C([2H])([2H])C([2H])([2H])C([2H])([2H])C([2H])([2H])C([2H])([2H])C([2H])([2H])C([2H])([2H])C([2H])([2H])C([2H])([2H])C([2H])([2H])C([2H])([2H])C([2H])([2H])C([2H])([2H])C([2H])([2H])[2H])=O

Computed Properties

  • Exact Mass: 317.478663003g/mol
  • Monoisotopic Mass: 317.478663003g/mol
  • Isotope Atom Count: 33
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 20
  • Rotatable Bond Count: 16
  • Complexity: 202
  • 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: 8.5
  • Topological Polar Surface Area: 26.3?2

Experimental Properties

  • Melting Point: 29.8-30.3?°C (lit.)
  • Boiling Point: 152-153?°C/0.05?mmHg(lit.)
  • Flash Point: Degrees Fahrenheit:>230°F
    Degrees Celsius:>110°C

Methyl heptadecanoate-d Security Information

  • Hazardous Material transportation number:NONH for all modes of transport
  • WGK Germany:3
  • Storage Condition:2-8°C

Methyl heptadecanoate-d Pricemore >>

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