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2-amino-N-[3-(trifluoromethyl)phenyl]acetamide

2-amino-N-[3-(trifluoromethyl)phenyl]acetamide

Formula: C9H9F3N2O

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

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

InChI: InChI=1S/C9H9F3N2O/c10-9(11,12)6-2-1-3-7(4-6)14-8(15)5-13/h1-4H,5,13H2,(H,14,15)

Composition: C (49.55%), H (4.16%), F (26.12%), N (12.84%), O (7.33%)

Molar Mass: 218.179

Atom Count: 24

Heavy Atom Count: 15

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 218.066697407
Formal Charge 0
FSP3 0.22
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 2
InChIKey XCABCOJPBRDHIL-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 50.25
Topological Polar Surface Area 55.12
Polarizability 17.94
Ring Count 1
Rotatable Bond Count 3

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Purity LeadTime Formula PacketSize UnitPrice
90% <16 Days C9H9F3N2O $33.80-$156.00$33.80$52.00$67.60$93.60$156.00
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