Trimethylolpropane triheptanoate

2,2-bis(heptanoyloxymethyl)butyl heptanoate

CAS: 78-16-0

Molecular Formula	`C27H50O6`
Molecular Weight	470.7 g/mol
LogP	8.3
Topological Polar Surface Area	78.9 A2
Hydrogen Bond Donors	0
Hydrogen Bond Acceptors	6
Rotatable Bonds	25
Exact Mass	470.36075
Heavy Atoms	33
Complexity	447.0

Chemical Identifiers

CAS Number	78-16-0
SMILES	`CCCCCCC(=O)OCC(CC)(COC(=O)CCCCCC)COC(=O)CCCCCC`
InChIKey	`UQJDVLPHTXQTRP-UHFFFAOYSA-N`

📖 Product Overview

Trimethylolpropane triheptanoate (CAS: 78-16-0) is a chemical compound with molecular formula C27H50O6 and molecular weight 470.7 g/mol. Its IUPAC systematic name is 2,2-bis(heptanoyloxymethyl)butyl heptanoate. LogP 8.3 Topological Polar Surface Area 78.9 A2 Hydrogen Bond Donors 0 Hydrogen Bond Acceptors 6 Rotatable Bonds 25 Exact Mass 470.36075 Heavy Atoms 33 Complexity 447.0 InChI Key: UQJDVLPHTXQTRP-UHFFFAOYSA-N. SMILES: CCCCCCC(=O)OCC(CC)(COC(=O)CCCCCC)COC(=O)CCCCCC.

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Safety Data Sheet (MSDS / SDS) View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.

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