Pentaerythrityl tetrastearate structure

Pentaerythrityl tetrastearate

[3-octadecanoyloxy-2,2-bis(octadecanoyloxymethyl)propyl] octadecanoate

CAS: 115-83-3
Molecular Formula C77H148O8
Molecular Weight 1202.0 g/mol
LogP 33.5
Topological Polar Surface Area 105.0 A2
Hydrogen Bond Donors 0
Hydrogen Bond Acceptors 8
Rotatable Bonds 76
Exact Mass 1201.1174
Heavy Atoms 85
Complexity 1180.0

Chemical Identifiers

CAS Number 115-83-3
SMILES CCCCCCCCCCCCCCCCCC(=O)OCC(COC(=O)CCCCCCCCCCCCCCCCC)(COC(=O)CCCCCCCCCCCCCCCCC)COC(=O)CCCCCCCCCCCCCCCCC
InChIKey OCKWAZCWKSMKNC-UHFFFAOYSA-N

📖 Product Overview

Pentaerythrityl tetrastearate (CAS: 115-83-3) is a chemical compound with molecular formula C77H148O8 and molecular weight 1202.0 g/mol. Its IUPAC systematic name is [3-octadecanoyloxy-2,2-bis(octadecanoyloxymethyl)propyl] octadecanoate. LogP 33.5 Topological Polar Surface Area 105.0 A2 Hydrogen Bond Donors 0 Hydrogen Bond Acceptors 8 Rotatable Bonds 76 Exact Mass 1201.1174 Heavy Atoms 85 Complexity 1180.0 InChI Key: OCKWAZCWKSMKNC-UHFFFAOYSA-N. SMILES: CCCCCCCCCCCCCCCCCC(=O)OCC(COC(=O)CCCCCCCCCCCCCCCCC)(COC(=O)CCCCCCCCCCCCCCCCC)COC(=O)CCCCCCCCCCCCCCCCC.

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