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4-[2-(piperidin-1-yl)ethoxy]benzoic acid hydrochloride

4-[2-(piperidin-1-yl)ethoxy]benzoic acid hydrochloride

CAS: 84449-80-9

Formula: C14H20ClNO3

SMILES: Cl.OC(=O)C1=CC=C(OCCN2CCCCC2)C=C1

IUPAC: 4-[2-(piperidin-1-yl)ethoxy]benzoic acid hydrochloride

InChI: InChI=1S/C14H19NO3.ClH/c16-14(17)12-4-6-13(7-5-12)18-11-10-15-8-2-1-3-9-15;/h4-7H,1-3,8-11H2,(H,16,17);1H

Composition: C (58.84%), H (7.05%), Cl (12.41%), N (4.90%), O (16.80%)

Molar Mass: 285.77

Atom Count: 39

Heavy Atom Count: 19

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 285.1131712
Formal Charge 0
FSP3 0.5
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 4
Hydrogen Bond Donor Count 1
InChIKey CMVTYSMYHSVDIU-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 69.94
Topological Polar Surface Area 49.77
Polarizability 27.02
Ring Count 2
Rotatable Bond Count 5

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Purity LeadTime CAS PacketSize UnitPrice
95% <7 Days 84449-80-9 $7.25-$104.54$7.25$9.32$15.53$31.05$104.54
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