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

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

CAS: 51736-39-1

Formula: C13H19F3N2O

SMILES: CCN(CC)CCOC1=C(N)C=C(C=C1)C(F)(F)F

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

InChI: InChI=1S/C13H19F3N2O/c1-3-18(4-2)7-8-19-12-6-5-10(9-11(12)17)13(14,15)16/h5-6,9H,3-4,7-8,17H2,1-2H3

Composition: C (56.51%), H (6.93%), F (20.63%), N (10.14%), O (5.79%)

Molar Mass: 276.303

Atom Count: 38

Heavy Atom Count: 19

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	276.144947729
Formal Charge	0
FSP3	0.54
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
InChIKey	DKIIYOCZGXETPR-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	70.71
Topological Polar Surface Area	38.49
Polarizability	25.78
Ring Count	1
Rotatable Bond Count	7

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