ethyl 2-acetyl-4,4,4-trifluoro-3-hydroxy-3-(trifluoromethyl)butanoate

CAS: 680-09-1

Molecular Formula	`C9H10F6O4`
Molecular Weight	296.16 g/mol
LogP	1.8
Topological Polar Surface Area	63.6 A2
Hydrogen Bond Donors	1
Hydrogen Bond Acceptors	10
Rotatable Bonds	5
Exact Mass	296.04834
Heavy Atoms	19
Complexity	345.0

Chemical Identifiers

CAS Number	680-09-1
SMILES	`CCOC(=O)C(C(=O)C)C(C(F)(F)F)(C(F)(F)F)O`
InChIKey	`QSJYRVSERRYRMJ-UHFFFAOYSA-N`

📖 Product Overview

ethyl 2-acetyl-4,4,4-trifluoro-3-hydroxy-3-(trifluoromethyl)butanoate (CAS: 680-09-1) is a chemical compound with molecular formula C9H10F6O4 and molecular weight 296.16 g/mol. Its IUPAC systematic name is ethyl 2-acetyl-4,4,4-trifluoro-3-hydroxy-3-(trifluoromethyl)butanoate. LogP 1.8 Topological Polar Surface Area 63.6 A2 Hydrogen Bond Donors 1 Hydrogen Bond Acceptors 10 Rotatable Bonds 5 Exact Mass 296.04834 Heavy Atoms 19 Complexity 345.0 InChI Key: QSJYRVSERRYRMJ-UHFFFAOYSA-N. SMILES: CCOC(=O)C(C(=O)C)C(C(F)(F)F)(C(F)(F)F)O.

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