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N-[4-(trifluoromethyl)phenyl]-1,3-benzoxazol-2-amine

N-[4-(trifluoromethyl)phenyl]-1,3-benzoxazol-2-amine

CAS: 39208-66-7

Formula: C14H9F3N2O

SMILES: FC(F)(F)C1=CC=C(NC2=NC3=CC=CC=C3O2)C=C1

IUPAC: N-[4-(trifluoromethyl)phenyl]-1,3-benzoxazol-2-amine

InChI: InChI=1S/C14H9F3N2O/c15-14(16,17)9-5-7-10(8-6-9)18-13-19-11-3-1-2-4-12(11)20-13/h1-8H,(H,18,19)

Composition: C (60.44%), H (3.26%), F (20.48%), N (10.07%), O (5.75%)

Molar Mass: 278.234

Atom Count: 29

Heavy Atom Count: 20

Properties
Properties
Common Names N/A
Aromatic Ring Count 3
Asymmetric Atom Count 0
Exact Mass 278.066697407
Formal Charge 0
FSP3 0.07
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 1
InChIKey NFKXGCHJNJLVNN-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 66.66
Topological Polar Surface Area 38.06
Polarizability 25.56
Ring Count 3
Rotatable Bond Count 3

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95% <5 Days 39208-66-7 $1,541.00-$3,138.00$1,541.00$3,138.00
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