2,5-dichloro-N-{[4-(hexyloxy)phenyl]methyl}aniline

2,5-dichloro-N-{[4-(hexyloxy)phenyl]methyl}aniline

CAS: 1040683-91-7

Formula: C19H23Cl2NO

SMILES: CCCCCCOC1=CC=C(CNC2=C(Cl)C=CC(Cl)=C2)C=C1

IUPAC: 2,5-dichloro-N-{[4-(hexyloxy)phenyl]methyl}aniline

InChI: InChI=1S/C19H23Cl2NO/c1-2-3-4-5-12-23-17-9-6-15(7-10-17)14-22-19-13-16(20)8-11-18(19)21/h6-11,13,22H,2-5,12,14H2,1H3

Composition: C (64.78%), H (6.58%), Cl (20.12%), N (3.98%), O (4.54%)

Molar Mass: 352.3

Atom Count: 46

Heavy Atom Count: 23

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	351.1156698
Formal Charge	0
FSP3	0.37
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
InChIKey	ZQJUDLRHTVHMSP-UHFFFAOYSA-N
Lipinski's Rule of Five
Molar Refractivity	100.01
Topological Polar Surface Area	21.26
Polarizability	38.35
Ring Count	2
Rotatable Bond Count	9

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