2,2,2-trifluoro-N-[3-(trifluoromethyl)phenyl]acetamide

2,2,2-trifluoro-N-[3-(trifluoromethyl)phenyl]acetamide

CAS: 2946-73-8

Formula: C9H5F6NO

SMILES: FC(F)(F)C(=O)NC1=CC=CC(=C1)C(F)(F)F

IUPAC: 2,2,2-trifluoro-N-[3-(trifluoromethyl)phenyl]acetamide

InChI: InChI=1S/C9H5F6NO/c10-8(11,12)5-2-1-3-6(4-5)16-7(17)9(13,14)15/h1-4H,(H,16,17)

Composition: C (42.04%), H (1.96%), F (44.33%), N (5.45%), O (6.22%)

Molar Mass: 257.135

Atom Count: 22

Heavy Atom Count: 17

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	257.027532763
Formal Charge	0
FSP3	0.22
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	1
Hydrogen Bond Donor Count	1
InChIKey	YSZXBKBYXXJXMS-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	47.9
Topological Polar Surface Area	29.1
Polarizability	16.35
Ring Count	1
Rotatable Bond Count	3

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