1-[2-(2-ethylphenoxy)ethyl]azepane hydrochloride

1-[2-(2-ethylphenoxy)ethyl]azepane hydrochloride

CAS: 1438272-42-4

Formula: C16H26ClNO

SMILES: Cl[H].CCC1=CC=CC=C1OCCN1CCCCCC1

IUPAC: 1-[2-(2-ethylphenoxy)ethyl]azepane hydrochloride

InChI: InChI=1S/C16H25NO.ClH/c1-2-15-9-5-6-10-16(15)18-14-13-17-11-7-3-4-8-12-17;/h5-6,9-10H,2-4,7-8,11-14H2,1H3;1H

Composition: C (67.71%), H (9.23%), Cl (12.49%), N (4.93%), O (5.64%)

Molar Mass: 283.84

Atom Count: 45

Heavy Atom Count: 19

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	283.1702922
Formal Charge	0
FSP3	0.62
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
InChIKey	JMIAUPZSIMYFEG-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	76.93
Topological Polar Surface Area	12.47
Polarizability	30.18
Ring Count	2
Rotatable Bond Count	5

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Purity	LeadTime	CAS	PacketSize	UnitPrice
99.91%	<7 Days	1438272-42-4		$171.11-$1,290.30$171.11$257.13$514.25$822.80$1,290.30

Molnova Chemicals

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Purity	LeadTime	CAS	PacketSize	UnitPrice
98%	<4 Days	1438272-42-4		$227.03-$1,576.96$227.03$326.40$467.05$700.95$1,050.29$1,576.96