N-[(2,5-dimethoxyphenyl)methyl]cycloheptanamine hydrochloride

N-[(2,5-dimethoxyphenyl)methyl]cycloheptanamine hydrochloride

CAS: 1609395-54-1

Formula: C16H26ClNO2

SMILES: Cl.COC1=CC(CNC2CCCCCC2)=C(OC)C=C1

IUPAC: N-[(2,5-dimethoxyphenyl)methyl]cycloheptanamine hydrochloride

InChI: InChI=1S/C16H25NO2.ClH/c1-18-15-9-10-16(19-2)13(11-15)12-17-14-7-5-3-4-6-8-14;/h9-11,14,17H,3-8,12H2,1-2H3;1H

Composition: C (64.09%), H (8.74%), Cl (11.82%), N (4.67%), O (10.67%)

Molar Mass: 299.84

Atom Count: 46

Heavy Atom Count: 20

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	299.1652068
Formal Charge	0
FSP3	0.62
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
InChIKey	LQYBISONCGQZQL-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	77.85
Topological Polar Surface Area	30.49
Polarizability	30.9
Ring Count	2
Rotatable Bond Count	5

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95%	<4 Days	1609395-54-1		$28.75-$1,214.40$28.75$116.15$297.85$1,214.40