1-[5-(2,5-dichlorophenoxymethyl)furan-2-carbonyl]azepane

1-[5-(2,5-dichlorophenoxymethyl)furan-2-carbonyl]azepane

Formula: C18H19Cl2NO3

SMILES: ClC1=CC(OCC2=CC=C(O2)C(=O)N2CCCCCC2)=C(Cl)C=C1

IUPAC: 1-{5-[(2,5-dichlorophenoxy)methyl]furan-2-carbonyl}azepane

InChI: InChI=1S/C18H19Cl2NO3/c19-13-5-7-15(20)17(11-13)23-12-14-6-8-16(24-14)18(22)21-9-3-1-2-4-10-21/h5-8,11H,1-4,9-10,12H2

Composition: C (58.71%), H (5.20%), Cl (19.25%), N (3.80%), O (13.03%)

Molar Mass: 368.25

Atom Count: 43

Heavy Atom Count: 24

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	367.0741989
Formal Charge	0
FSP3	0.39
Hetero Ring Count	2
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
InChIKey	DQDYJTVTXVFLDC-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	94.63
Topological Polar Surface Area	42.68
Polarizability	36.28
Ring Count	3
Rotatable Bond Count	4

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Purity	LeadTime	Formula		UnitPrice
98%	<10 Days	C18H19Cl2NO3		Quote Only