Trihexyl borate structure

Trihexyl borate

trihexyl borate

CAS: 5337-36-0
Molecular Formula C18H39BO3
Molecular Weight 314.3 g/mol
Topological Polar Surface Area 27.7 A2
Hydrogen Bond Donors 0
Hydrogen Bond Acceptors 3
Rotatable Bonds 18
Exact Mass 314.29922
Heavy Atoms 22
Complexity 169.0

Chemical Identifiers

CAS Number 5337-36-0
SMILES B(OCCCCCC)(OCCCCCC)OCCCCCC
InChIKey KDQYHGMMZKMQAA-UHFFFAOYSA-N

📖 Product Overview

Trihexyl borate (CAS: 5337-36-0) is a chemical compound with molecular formula C18H39BO3 and molecular weight 314.3 g/mol. Its IUPAC systematic name is trihexyl borate. Topological Polar Surface Area 27.7 A2 Hydrogen Bond Donors 0 Hydrogen Bond Acceptors 3 Rotatable Bonds 18 Exact Mass 314.29922 Heavy Atoms 22 Complexity 169.0 InChI Key: KDQYHGMMZKMQAA-UHFFFAOYSA-N. SMILES: B(OCCCCCC)(OCCCCCC)OCCCCCC.

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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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