N-[(2-fluorophenyl)methyl]-3-propoxyaniline

N-[(2-fluorophenyl)methyl]-3-propoxyaniline

CAS: 1040684-14-7

Formula: C16H18FNO

SMILES: CCCOC1=CC=CC(NCC2=C(F)C=CC=C2)=C1

IUPAC: N-[(2-fluorophenyl)methyl]-3-propoxyaniline

InChI: InChI=1S/C16H18FNO/c1-2-10-19-15-8-5-7-14(11-15)18-12-13-6-3-4-9-16(13)17/h3-9,11,18H,2,10,12H2,1H3

Composition: C (74.11%), H (7.00%), F (7.33%), N (5.40%), O (6.17%)

Molar Mass: 259.324

Atom Count: 37

Heavy Atom Count: 19

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	259.137242367
Formal Charge	0
FSP3	0.25
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
InChIKey	PQGCWBKPWKIZQQ-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	76.82
Topological Polar Surface Area	21.26
Polarizability	28.75
Ring Count	2
Rotatable Bond Count	6

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