4-(2,5-dichlorophenoxymethyl)piperidine

4-(2,5-dichlorophenoxymethyl)piperidine

CAS: 946680-60-0

Formula: C12H15Cl2NO

SMILES: ClC1=CC(OCC2CCNCC2)=C(Cl)C=C1

IUPAC: 4-[(2,5-dichlorophenoxy)methyl]piperidine

InChI: InChI=1S/C12H15Cl2NO/c13-10-1-2-11(14)12(7-10)16-8-9-3-5-15-6-4-9/h1-2,7,9,15H,3-6,8H2

Composition: C (55.40%), H (5.81%), Cl (27.25%), N (5.38%), O (6.15%)

Molar Mass: 260.16

Atom Count: 31

Heavy Atom Count: 16

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	259.0530695
Formal Charge	0
FSP3	0.5
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
InChIKey	HWNALSNAIOVPMS-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	67.11
Topological Polar Surface Area	21.26
Polarizability	26.62
Ring Count	2
Rotatable Bond Count	3

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