2-(2,5-dimethylphenoxy)-5-(trifluoromethyl)aniline

2-(2,5-dimethylphenoxy)-5-(trifluoromethyl)aniline

CAS: 937596-50-4

Formula: C15H14F3NO

SMILES: CC1=CC(OC2=C(N)C=C(C=C2)C(F)(F)F)=C(C)C=C1

IUPAC: 2-(2,5-dimethylphenoxy)-5-(trifluoromethyl)aniline

InChI: InChI=1S/C15H14F3NO/c1-9-3-4-10(2)14(7-9)20-13-6-5-11(8-12(13)19)15(16,17)18/h3-8H,19H2,1-2H3

Composition: C (64.05%), H (5.02%), F (20.26%), N (4.98%), O (5.69%)

Molar Mass: 281.278

Atom Count: 34

Heavy Atom Count: 20

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	281.102748564
Formal Charge	0
FSP3	0.2
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	1
Hydrogen Bond Donor Count	1
InChIKey	UOITXKZEDUPSEZ-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	73.06
Topological Polar Surface Area	35.25
Polarizability	26.34
Ring Count	2
Rotatable Bond Count	3

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