2-(2,2,2-trifluoroethoxy)aniline

2-(2,2,2-trifluoroethoxy)aniline

CAS: 57946-60-8

Formula: C8H8F3NO

SMILES: NC1=CC=CC=C1OCC(F)(F)F

IUPAC: 2-(2,2,2-trifluoroethoxy)aniline

InChI: InChI=1S/C8H8F3NO/c9-8(10,11)5-13-7-4-2-1-3-6(7)12/h1-4H,5,12H2

Composition: C (50.27%), H (4.22%), F (29.82%), N (7.33%), O (8.37%)

Molar Mass: 191.153

Atom Count: 21

Heavy Atom Count: 13

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	191.055798371
Formal Charge	0
FSP3	0.25
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
InChIKey	JIKIVGTUYSNUPQ-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	42.67
Topological Polar Surface Area	35.25
Polarizability	15.24
Ring Count	1
Rotatable Bond Count	3

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