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Octadecanoic acid, 1,1'-((2-heptadecyl-4(5H)-oxazolylidene)bis(methylene)) ester

HCID 95104
NotesReactions
Basic informationNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes
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Basic information

CAS
15655-33-1
Standard SMILES
CCCCCCCCCCCCCCCCCC(=O)OCC1(COC(=O)CCCCCCCCCCCCCCCCC)COC(CCCCCCCCCCCCCCCCC)=N1
InChIKey
BPUYDDKNZNJELI-UHFFFAOYSA-N
Molecular formula
C58H111NO5
Average molar mass
902.5 g/mol
Monoisotopic mass
901.84622564

Names & identifiers

Preferred name
Octadecanoic acid, 1,1'-((2-heptadecyl-4(5H)-oxazolylidene)bis(methylene)) ester
IUPAC
[2-heptadecyl-4-(octadecanoyloxymethyl)-5H-1,3-oxazol-4-yl]methyl octadecanoate
English name
(2-heptadecyl(5H)-oxazol-4-ylidene)bis(methylene) distearate
Molecular formula
C58H111NO5
Molecular weight
902.51

Names & synonyms

15655-33-1TS 970Octadecanoic acid, (2-heptadecyl-4(5H)-oxazolylidene)bis(methylene) esterLGT06PGC4LEINECS 239-725-4UNII-LGT06PGC4LNSC 17740NSC-17740Octadecanoic acid, 1,1'-((2-heptadecyl-4(5H)-oxazolylidene)bis(methylene)) esterStearic acid, (2-heptadecyl-2-oxazolin-4-ylidene)dimethylene ester2-HEPTADECYL-4,4-BIS(OCTADECANOYLOXYMETHYL)-2-OXAZOLINE2-OXAZOLINE-4,4-DIMETHANOL, 2-HEPTADECYL-, DISTEARATE (ESTER)
Show more names
2HEPTADECYL44BISMETHYLENESTEARATE13OXAZOLINE2-Heptadecyl-2-oxazoline-4,4-dimethanol dioctadecanoateBis(octadecanoic acid)[2-heptadecyloxazol-4(5H)-ylidene]bis(methylene) ester
Octadecanoic acid, 1,1'-[(2-heptadecyl-4(5H)-oxazolylidene)bis(methylene)] esterRefChem:167609Octadecanoic acid, (2-heptadecyl-4(5H)-oxazolylidene)bis(methylene) ester (9CI)239-725-4[2-heptadecyl-4-(octadecanoyloxymethyl)-5H-1,3-oxazol-4-yl]methyl octadecanoate(2-Heptadecyl-4,5-dihydrooxazole-4,4-diyl)bis(methylene) distearate(2-Heptadecyl(5H)-oxazol-4-ylidene)bis(methylene) distearateSCHEMBL11871602

Properties

Computed structural properties

XLogP
24.7
Topological polar surface area
74.2 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
6
Rotatable bonds
54
Heavy atoms
64
Formal charge
0
Complexity
978

Physicochemical properties

FDA UNII
6 PGC4L · LGT06PGC4L
EPA Substance Registry System
Octadecanoic acid, (2-heptadecyl-4(5H)-oxazolylidene)bis(methylene) ester (15655-33-1)
TSCA
TSCA listed

Safety & regulation

Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.

Safety data

tsca
TSCA listed

Chemistry & industry

Uses & manufacturing

General Manufacturing InformationOctadecanoic acid, 1,1'-[(2-heptadecyl-4(5H)-oxazolylidene)bis(methylene)] ester: INACTIVE

Suppliers1 total

DAYANG CHEM (HANGZHOU) CO.,LTD+86-88938639 +86-17705817739 · [email protected]

Related reactions

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Compound notes

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On this pageBasic informationNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes

Database identifiers

CAS
15655-33-1
PubChem CID
95104
DTXSID
DTXSID50935474
UNII
LGT06PGC4L
EC Number
239-725-4
Nikkaji
J404.151H