1-[5-(2-chlorophenoxymethyl)furan-2-carbonyl]azepane

1-[5-(2-chlorophenoxymethyl)furan-2-carbonyl]azepane

Formula: C18H20ClNO3

SMILES: ClC1=CC=CC=C1OCC1=CC=C(O1)C(=O)N1CCCCCC1

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

InChI: InChI=1S/C18H20ClNO3/c19-15-7-3-4-8-16(15)22-13-14-9-10-17(23-14)18(21)20-11-5-1-2-6-12-20/h3-4,7-10H,1-2,5-6,11-13H2

Composition: C (64.77%), H (6.04%), Cl (10.62%), N (4.20%), O (14.38%)

Molar Mass: 333.81

Atom Count: 43

Heavy Atom Count: 23

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	333.1131712
Formal Charge	0
FSP3	0.39
Hetero Ring Count	2
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
InChIKey	MKRVVBQAJLOUNY-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	89.82
Topological Polar Surface Area	42.68
Polarizability	34.37
Ring Count	3
Rotatable Bond Count	4

Suppliers

Molecule Market Select

Purity	LeadTime	Formula		UnitPrice
98%	<10 Days	C18H20ClNO3		Quote Only