2-{[1,1'-biphenyl]-4-yloxy}-5-(trifluoromethyl)aniline

2-{[1,1'-biphenyl]-4-yloxy}-5-(trifluoromethyl)aniline

CAS: 904253-69-6

Formula: C19H14F3NO

SMILES: NC1=C(OC2=CC=C(C=C2)C2=CC=CC=C2)C=CC(=C1)C(F)(F)F

IUPAC: 2-{[1,1'-biphenyl]-4-yloxy}-5-(trifluoromethyl)aniline

InChI: InChI=1S/C19H14F3NO/c20-19(21,22)15-8-11-18(17(23)12-15)24-16-9-6-14(7-10-16)13-4-2-1-3-5-13/h1-12H,23H2

Composition: C (69.30%), H (4.29%), F (17.31%), N (4.25%), O (4.86%)

Molar Mass: 329.322

Atom Count: 38

Heavy Atom Count: 24

Properties

Properties

Common Names	N/A
Aromatic Ring Count	3
Asymmetric Atom Count	0
Exact Mass	329.102748564
Formal Charge	0
FSP3	0.05
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	1
Hydrogen Bond Donor Count	1
InChIKey	SHPKCCVIJLYQFA-UHFFFAOYSA-N
Lipinski's Rule of Five
Molar Refractivity	88.11
Topological Polar Surface Area	35.25
Polarizability	33.63
Ring Count	3
Rotatable Bond Count	4

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