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Dipentaerythrityl hexaheptanoate/hexacaprylate/hexacaprate

Catalog Number

ACM70851046-1

CAS

70851-04-6

Structure

IUPAC Name

Dodecanoic acid;heptanoic acid;2-[[3-hydroxy-2,2-bis(hydroxymethyl)propoxy]methyl]-2-(hydroxymethyl)propane-1,3-diol;octanoic acid

Synonyms

Decanoic acid, mixed esters with dipentaerythritol, heptanoic acid and octanoic acid

Molecular Weight

927.29-1179.77

Molecular Formula

C52H94O13-C70H130O13

Canonical SMILES

CCCCCCCCCCCC(=O)O.CCCCCCCC(=O)O.CCCCCCC(=O)O.C(C(CO)(CO)COCC(CO)(CO)CO)O

InChI

CRHNOMJSBBTFTE-UHFFFAOYSA-N

InChI Key

InChI=1S/C12H24O2.C10H22O7.C8H16O2.C7H14O2/c1-2-3-4-5-6-7-8-9-10-11-12(13)14;11-1-9(2-12,3-13)7-17-8-10(4-14,5-15)6-16;1-2-3-4-5-6-7-8(9)10;1-2-3-4-5-6-7(8)9/h2-11H2,1H3,(H,13,14);11-16H,1-8H2;2-7H2,1H3,(H,9,10);2-6H2,1H3,(H,8,9)

Active Content

95%

Physical State

Liquid

Typical Applications

Emollient

MSDS

Download MSDS

COA

Download COA

Spec Sheet

Download Spec Sheet

Custom Q&A

What is the CAS number of Dipentaerythrityl hexaheptanoate?

The CAS number is 70851-04-6.

What are the synonyms for Dipentaerythrityl hexaheptanoate?

The synonyms for Dipentaerythrityl hexaheptanoate are Decanoic acid, mixed esters with dipentaerythritol, heptanoic acid and octanoic acid.

What is the molecular weight range of Dipentaerythrityl hexaheptanoate?

The molecular weight range is 927.29-1179.77.

What is the molecular formula of Dipentaerythrityl hexaheptanoate?

The molecular formula is C52H94O13-C70H130O13.

What is the SMILES notation for Dipentaerythrityl hexaheptanoate?

The SMILES notation for Dipentaerythrityl hexaheptanoate is CCCCCCCCCCCC(=O)O.CCCCCCCC(=O)O.CCCCCCC(=O)O.C(C(CO)(CO)COCC(CO)(CO)CO)O.

What is the InChI of Dipentaerythrityl hexaheptanoate?

The InChI is CRHNOMJSBBTFTE-UHFFFAOYSA-N.

What is the InChI Key of Dipentaerythrityl hexaheptanoate?

The InChI Key is InChI=1S/C12H24O2.C10H22O7.C8H16O2.C7H14O2/c1-2-3-4-5-6-7-8-9-10-11-12(13)14;11-1-9(2-12,3-13)7-17-8-10(4-14,5-15)6-16;1-2-3-4-5-6-7-8(9)10;1-2-3-4-5-6-7(8)9/h2-11H2,1H3,(H,13,14);11-16H,1-8H2;2-7H2,1H3,(H,9,10);2-6H2,1H3,(H,8,9).

What is the physical state of Dipentaerythrityl hexaheptanoate?

The physical state is liquid.

What is a typical application of Dipentaerythrityl hexaheptanoate?

A typical application is as an emollient.

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