1-(benzyloxy)-4,4,4-trifluorobutan-2-one

1-(benzyloxy)-4,4,4-trifluorobutan-2-one

CAS: 1344733-45-4

Formula: C11H11F3O2

SMILES: FC(F)(F)CC(=O)COCC1=CC=CC=C1

IUPAC: 1-(benzyloxy)-4,4,4-trifluorobutan-2-one

InChI: InChI=1S/C11H11F3O2/c12-11(13,14)6-10(15)8-16-7-9-4-2-1-3-5-9/h1-5H,6-8H2

Composition: C (56.90%), H (4.78%), F (24.55%), O (13.78%)

Molar Mass: 232.202

Atom Count: 27

Heavy Atom Count: 16

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	232.071114083
Formal Charge	0
FSP3	0.36
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
InChIKey	YVRIEBHNJAOGCT-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	52.82
Topological Polar Surface Area	26.3
Polarizability	19.65
Ring Count	1
Rotatable Bond Count	6

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