4-{[(1-bromonaphthalen-2-yl)oxy]methyl}piperidine

4-{[(1-bromonaphthalen-2-yl)oxy]methyl}piperidine

CAS: 946725-44-6

Formula: C16H18BrNO

SMILES: BrC1=C2C=CC=CC2=CC=C1OCC1CCNCC1

IUPAC: 4-{[(1-bromonaphthalen-2-yl)oxy]methyl}piperidine

InChI: InChI=1S/C16H18BrNO/c17-16-14-4-2-1-3-13(14)5-6-15(16)19-11-12-7-9-18-10-8-12/h1-6,12,18H,7-11H2

Composition: C (60.01%), H (5.67%), Br (24.95%), N (4.37%), O (5.00%)

Molar Mass: 320.23

Atom Count: 37

Heavy Atom Count: 19

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	319.057177
Formal Charge	0
FSP3	0.37
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
InChIKey	MLTSICBWAIFESH-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	81.57
Topological Polar Surface Area	21.26
Polarizability	33.01
Ring Count	3
Rotatable Bond Count	3

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