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Substance Name: Tripentaerythritol octaoleate
RN: 20284-29-1
InChIKey: ADGHQLSHWNXHQZ-PKXWZVDDSA-N

Molecular Formula

  • C159-H288-O18

Molecular Weight

  • 2488.01
 
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Names and Synonyms

Results Name

  • Tripentaerythritol octaoleate

Synonyms

  • EINECS 243-682-7
  • Tripentaerythritol, octaoleate

Systematic Names

  • 9-Octadecenoic acid (9Z)-, 1,1'-(2,2-bis((3-(((9Z)-1-oxo-9-octadecen-1-yl)oxy)-2,2-bis((((9Z)-1-oxo-9-octadecen-1-yl)oxy)methyl)propoxy)methyl)-1,3-propanediyl) ester
  • 9-Octadecenoic acid (9Z)-, 2,2-bis((3-(((9Z)-1-oxo-9-octadecenyl)oxy)-2,2-bis((((9Z)-1-oxo-9-octadecenyl)oxy)methyl)propoxy)methyl)-1,3-propanediyl ester
  • Octaoleic acid, octaester with tripentaerythritol

Registry Numbers

CAS Registry Number

  • 20284-29-1

System Generated Number

  • 0020284291

Structure Descriptors

InChI

1S/C159H288O18/c1-9-17-25-33-41-49-57-65-73-81-89-97-105-113-121-129-149(160)170-141-157(142-171-150(161)130-122-114-106-98-90-82-74-66-58-50-42-34-26-18-10-2,137-168-139-158(143-172-151(162)131-123-115-107-99-91-83-75-67-59-51-43-35-27-19-11-3,144-173-152(163)132-124-116-108-100-92-84-76-68-60-52-44-36-28-20-12-4)145-174-153(164)133-125-117-109-101-93-85-77-69-61-53-45-37-29-21-13-5)138-169-140-159(146-175-154(165)134-126-118-110-102-94-86-78-70-62-54-46-38-30-22-14-6,147-176-155(166)135-127-119-111-103-95-87-79-71-63-55-47-39-31-23-15-7)148-177-156(167)136-128-120-112-104-96-88-80-72-64-56-48-40-32-24-16-8/h65-80H,9-64,81-148H2,1-8H3/b73-65+,74-66+,75-67-,76-68+,77-69+,78-70+,79-71+,80-72+

InChIKey

ADGHQLSHWNXHQZ-PKXWZVDDSA-N

Smiles

C(C(COC(CCCCCCC\C=C\CCCCCCCC)=O)(COCC(COC(CCCCCCC\C=C\CCCCCCCC)=O)(COC(CCCCCCC\C=C/CCCCCCCC)=O)COC(CCCCCCC\C=C\CCCCCCCC)=O)COCC(COC(CCCCCCC\C=C\CCCCCCCC)=O)(COC(CCCCCCC\C=C\CCCCCCCC)=O)COC(CCCCCCC\C=C\CCCCCCCC)=O)OC(CCCCCCC\C=C\CCCCCCCC)=O