Hexadecanoic-2,2-d2 acid, 1,2,3-propanetriyl ester

CAS Registry Number®

241157-06-2
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CAS Name

Hexadecanoic-2,2-d2 acid, 1,2,3-propanetriyl ester

Molecular Formula

C51H92D6O6

Cite this Page

Hexadecanoic-2,2-d2 acid, 1,2,3-propanetriyl ester.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=241157-06-2 (retrieved 2024-08-31) (CAS RN: 241157-06-2).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C51H98O6/c1-4-7-10-13-16-19-22-25-28-31-34-37-40-43-49(52)55-46-48(57-51(54)45-42-39-36-33-30-27-24-21-18-15-12-9-6-3)47-56-50(53)44-41-38-35-32-29-26-23-20-17-14-11-8-5-2/h48H,4-47H2,1-3H3/i43D2,44D2,45D2

InChIKey

InChIKey=PVNIQBQSYATKKL-LYUMNRDXSA-N

SMILES

C(OC(C(CCCCCCCCCCCCCC)([2H])[2H])=O)(COC(C(CCCCCCCCCCCCCC)([2H])[2H])=O)COC(C(CCCCCCCCCCCCCC)([2H])[2H])=O

Canonical SMILES

O=C(OCC(OC(=O)CCCCCCCCCCCCCCC)COC(=O)CCCCCCCCCCCCCCC)CCCCCCCCCCCCCCC

Other Names for this Substance

  • Hexadecanoic-2,2-d2 acid, 1,2,3-propanetriyl ester