Compound C11H17BF6O3

6-tert-butyl-2-ethoxy-4,4-bis(trifluoromethyl)-1,3,2-dioxaborinane

CAS: 100991-78-4

Molecular Formula	`C11H17BF6O3`
Molecular Weight	322.05 g/mol
Topological Polar Surface Area	27.7 A2
Hydrogen Bond Donors	0
Hydrogen Bond Acceptors	9
Rotatable Bonds	3
Exact Mass	322.1175
Heavy Atoms	21
Complexity	348.0

Chemical Identifiers

CAS Number	100991-78-4
SMILES	`B1(OC(CC(O1)(C(F)(F)F)C(F)(F)F)C(C)(C)C)OCC`
InChIKey	`WQBJAVALEDDXNF-UHFFFAOYSA-N`

📖 Product Overview

Compound C11H17BF6O3 (CAS: 100991-78-4) is a chemical compound with molecular formula C11H17BF6O3 and molecular weight 322.05 g/mol. Its IUPAC systematic name is 6-tert-butyl-2-ethoxy-4,4-bis(trifluoromethyl)-1,3,2-dioxaborinane. Topological Polar Surface Area 27.7 A2 Hydrogen Bond Donors 0 Hydrogen Bond Acceptors 9 Rotatable Bonds 3 Exact Mass 322.1175 Heavy Atoms 21 Complexity 348.0 InChI Key: WQBJAVALEDDXNF-UHFFFAOYSA-N. SMILES: B1(OC(CC(O1)(C(F)(F)F)C(F)(F)F)C(C)(C)C)OCC.

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