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2-chloro-6-(trifluoromethoxy)aniline

2-chloro-6-(trifluoromethoxy)aniline

CAS: 1261673-70-4

Formula: C7H5ClF3NO

SMILES: NC1=C(Cl)C=CC=C1OC(F)(F)F

IUPAC: 2-chloro-6-(trifluoromethoxy)aniline

InChI: InChI=1S/C7H5ClF3NO/c8-4-2-1-3-5(6(4)12)13-7(9,10)11/h1-3H,12H2

Composition: C (39.74%), H (2.38%), Cl (16.76%), F (26.94%), N (6.62%), O (7.56%)

Molar Mass: 211.57

Atom Count: 18

Heavy Atom Count: 13

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 211.001176
Formal Charge 0
FSP3 0.14
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 1
InChIKey NNDFBODLWFJOSA-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 38.63
Topological Polar Surface Area 35.25
Polarizability 15.47
Ring Count 1
Rotatable Bond Count 2

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