Chem
J-GLOBAL ID:200907064995460163
Nikkaji number:J1.659.169F
Didodecylmalonic acid bis(3,6,9,12,15,18,21,24,27,30,33,36,39,42,45,48-hexadecaoxanonatetracontane-1-yl) ester
ジドデシルマロン酸ビス(3,6,9,12,15,18,21,24,27,30,33,36,39,42,45,48-ヘキサデカオキサノナテトラコンタン-1-イル)
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Substance type:
Substance type
Substance type classified into 3 categories. Decided structure: Substances with a clear structure Undicided Structure: Substances with unknown or undetermined structure Mixtures: Mixtures, racemic compounds, or compounds with relative structural arrangements
Decided structure
Molecular formula:
C93 H184 O36
Molecular formula furigana:
C93-H184-O36
Molecular weight:
1878.459
InChI:
InChI=1S/C93H184O36/c1-5-7-9-11-13-15-17-19-21-23-25-93(26-24-22-20-18-16-14-12-10-8-6-2,91(94)128-89-87-126-85-83-124-81-79-122-77-75-120-73-71-118-69-67-116-65-63-114-61-59-112-57-55-110-53-51-108-49-47-106-45-43-104-41-39-102-37-35-100-33-31-98-29-27-96-3)92(95)129-90-88-127-86-84-125-82-80-123-78-76-121-74-72-119-70-68-117-66-64-115-62-60-113-58-56-111-54-52-109-50-48-107-46-44-105-42-40-103-38-36-101-34-32-99-30-28-97-4/h5-90H2,1-4H3
InChI key:
NVPAEKWNQSYZGQ-UHFFFAOYSA-N
SMILES:
CCCCCCCCCCCCC(CCCCCCCCCCCC)(C(=O)OCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOC)C(=O)OCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOC
Systematic name (3):
ジドデシルマロン酸ビス(3,6,9,12,15,18,21,24,27,30,33,36,39,42,45,48-ヘキサデカオキサノナテトラコンタン-1-イル)
1,3-ビス(2,5,8,11,14,17,20,23,26,29,32,35,38,41,44,47-ヘキサデカオキサノナテトラコンタン-49-イル) 2,2-ジドデシルプロパンジオアート
1,3-bis(2,5,8,11,14,17,20,23,26,29,32,35,38,41,44,47-hexadecaoxanonatetracontan-49-yl) 2,2-didodecylpropanedioate
Other name (1):
Didodecylmalonic acid bis(3,6,9,12,15,18,21,24,27,30,33,36,39,42,45,48-hexadecaoxanonatetracontane-1-yl) ester
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