2-(4-hydroxypiperidin-1-yl)benzaldehyde hydrochloride

2-(4-hydroxypiperidin-1-yl)benzaldehyde hydrochloride

CAS: 1185302-49-1

Formula: C12H16ClNO2

SMILES: Cl.OC1CCN(CC1)C1=C(C=O)C=CC=C1

IUPAC: 2-(4-hydroxypiperidin-1-yl)benzaldehyde hydrochloride

InChI: InChI=1S/C12H15NO2.ClH/c14-9-10-3-1-2-4-12(10)13-7-5-11(15)6-8-13;/h1-4,9,11,15H,5-8H2;1H

Composition: C (59.63%), H (6.67%), Cl (14.67%), N (5.79%), O (13.24%)

Molar Mass: 241.72

Atom Count: 32

Heavy Atom Count: 16

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	241.0869565
Formal Charge	0
FSP3	0.42
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
InChIKey	DSNMGRMABZDEIQ-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	60.79
Topological Polar Surface Area	40.54
Polarizability	22.46
Ring Count	2
Rotatable Bond Count	2

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