3-chloro-N-[2-(4-chloro-3,5-dimethylphenoxy)ethyl]-2-methylaniline

3-chloro-N-[2-(4-chloro-3,5-dimethylphenoxy)ethyl]-2-methylaniline

CAS: 1040687-97-5

Formula: C17H19Cl2NO

SMILES: CC1=CC(OCCNC2=C(C)C(Cl)=CC=C2)=CC(C)=C1Cl

IUPAC: 3-chloro-N-[2-(4-chloro-3,5-dimethylphenoxy)ethyl]-2-methylaniline

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

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	VHTHOQQCVYGKQF-UHFFFAOYSA-N
Lipinski's Rule of Five
Molar Refractivity	91.54
Topological Polar Surface Area	21.26
Polarizability	34.43
Ring Count	2
Rotatable Bond Count	5

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