2-butoxy-N-[(3,5-dichlorophenyl)methyl]aniline

2-butoxy-N-[(3,5-dichlorophenyl)methyl]aniline

CAS: 1040689-76-6

Formula: C17H19Cl2NO

SMILES: CCCCOC1=C(NCC2=CC(Cl)=CC(Cl)=C2)C=CC=C1

IUPAC: 2-butoxy-N-[(3,5-dichlorophenyl)methyl]aniline

InChI: InChI=1S/C17H19Cl2NO/c1-2-3-8-21-17-7-5-4-6-16(17)20-12-13-9-14(18)11-15(19)10-13/h4-7,9-11,20H,2-3,8,12H2,1H3

Composition: C (62.97%), H (5.91%), Cl (21.87%), N (4.32%), O (4.93%)

Molar Mass: 324.25

Atom Count: 40

Heavy Atom Count: 21

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	323.0843696
Formal Charge	0
FSP3	0.29
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
InChIKey	ONBPHVQGJGABLV-UHFFFAOYSA-N
Lipinski's Rule of Five
Molar Refractivity	90.81
Topological Polar Surface Area	21.26
Polarizability	34.67
Ring Count	2
Rotatable Bond Count	7

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