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2-(trifluoromethoxy)benzamide

2-(trifluoromethoxy)benzamide

CAS: 127979-74-2

Formula: C8H6F3NO2

SMILES: NC(=O)C1=CC=CC=C1OC(F)(F)F

IUPAC: 2-(trifluoromethoxy)benzamide

InChI: InChI=1S/C8H6F3NO2/c9-8(10,11)14-6-4-2-1-3-5(6)7(12)13/h1-4H,(H2,12,13)

Composition: C (46.84%), H (2.95%), F (27.78%), N (6.83%), O (15.60%)

Molar Mass: 205.136

Atom Count: 20

Heavy Atom Count: 14

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 205.035062926
Formal Charge 0
FSP3 0.12
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 1
InChIKey XXTXDVUAHROLBN-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 38.21
Topological Polar Surface Area 52.32
Polarizability 15.26
Ring Count 1
Rotatable Bond Count 3

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97% <7 Days 127979-74-2 $147.73-$818.13$147.73$303.88$818.13
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97% <6 Days 127979-74-2 $39.10-$67.85$39.10$67.85
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