5-fluoro-2-(3-phenylpropoxy)aniline

5-fluoro-2-(3-phenylpropoxy)aniline

CAS: 946716-75-2

Formula: C15H16FNO

SMILES: NC1=C(OCCCC2=CC=CC=C2)C=CC(F)=C1

IUPAC: 5-fluoro-2-(3-phenylpropoxy)aniline

InChI: InChI=1S/C15H16FNO/c16-13-8-9-15(14(17)11-13)18-10-4-7-12-5-2-1-3-6-12/h1-3,5-6,8-9,11H,4,7,10,17H2

Composition: C (73.45%), H (6.57%), F (7.75%), N (5.71%), O (6.52%)

Molar Mass: 245.297

Atom Count: 34

Heavy Atom Count: 18

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	245.121592302
Formal Charge	0
FSP3	0.2
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
InChIKey	FMAPDRGHGPLSOR-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	71.41
Topological Polar Surface Area	35.25
Polarizability	26.84
Ring Count	2
Rotatable Bond Count	5

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