3-methoxy-4-[2-(piperidin-1-yl)ethoxy]benzaldehyde hydrochloride

3-methoxy-4-[2-(piperidin-1-yl)ethoxy]benzaldehyde hydrochloride

CAS: 138351-16-3

Formula: C15H22ClNO3

SMILES: Cl.COC1=C(OCCN2CCCCC2)C=CC(C=O)=C1

IUPAC: 3-methoxy-4-[2-(piperidin-1-yl)ethoxy]benzaldehyde hydrochloride

InChI: InChI=1S/C15H21NO3.ClH/c1-18-15-11-13(12-17)5-6-14(15)19-10-9-16-7-3-2-4-8-16;/h5-6,11-12H,2-4,7-10H2,1H3;1H

Composition: C (60.10%), H (7.40%), Cl (11.82%), N (4.67%), O (16.01%)

Molar Mass: 299.8

Atom Count: 42

Heavy Atom Count: 20

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	299.1288213
Formal Charge	0
FSP3	0.53
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	0
InChIKey	MNFHFFOPQWNYRJ-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	75.73
Topological Polar Surface Area	38.77
Polarizability	29.1
Ring Count	2
Rotatable Bond Count	6

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