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2-chloro-4'-(trifluoromethyl)-[1,1'-biphenyl]-3-amine

2-chloro-4'-(trifluoromethyl)-[1,1'-biphenyl]-3-amine

Formula: C13H9ClF3N

SMILES: NC1=CC=CC(=C1Cl)C1=CC=C(C=C1)C(F)(F)F

IUPAC: 2-chloro-4'-(trifluoromethyl)-[1,1'-biphenyl]-3-amine

InChI: InChI=1S/C13H9ClF3N/c14-12-10(2-1-3-11(12)18)8-4-6-9(7-5-8)13(15,16)17/h1-7H,18H2

Composition: C (57.48%), H (3.34%), Cl (13.05%), F (20.98%), N (5.16%)

Molar Mass: 271.67

Atom Count: 27

Heavy Atom Count: 18

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 0
Exact Mass 271.0375615
Formal Charge 0
FSP3 0.08
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 1
Hydrogen Bond Donor Count 1
InChIKey VSZCRSSLVZMFJS-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 66.67
Topological Polar Surface Area 26.02
Polarizability 25.26
Ring Count 2
Rotatable Bond Count 2

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