2-[2-(2-methoxyethoxy)ethoxy]-5-(trifluoromethyl)aniline

2-[2-(2-methoxyethoxy)ethoxy]-5-(trifluoromethyl)aniline

CAS: 946715-30-6

Formula: C12H16F3NO3

SMILES: COCCOCCOC1=C(N)C=C(C=C1)C(F)(F)F

IUPAC: 2-[2-(2-methoxyethoxy)ethoxy]-5-(trifluoromethyl)aniline

InChI: InChI=1S/C12H16F3NO3/c1-17-4-5-18-6-7-19-11-3-2-9(8-10(11)16)12(13,14)15/h2-3,8H,4-7,16H2,1H3

Composition: C (51.61%), H (5.78%), F (20.41%), N (5.02%), O (17.19%)

Molar Mass: 279.259

Atom Count: 35

Heavy Atom Count: 19

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	279.108227868
Formal Charge	0
FSP3	0.5
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	1
InChIKey	UMJDUNSHRDAKIU-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	65.28
Topological Polar Surface Area	53.71
Polarizability	23.97
Ring Count	1
Rotatable Bond Count	8

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