[(2-chlorophenyl)methyl][2-(2,4-dichlorophenoxy)propyl]amine

[(2-chlorophenyl)methyl][2-(2,4-dichlorophenoxy)propyl]amine

CAS: 1040684-13-6

Formula: C16H16Cl3NO

SMILES: CC(CNCC1=C(Cl)C=CC=C1)OC1=C(Cl)C=C(Cl)C=C1

IUPAC: [(2-chlorophenyl)methyl][2-(2,4-dichlorophenoxy)propyl]amine

InChI: InChI=1/C16H16Cl3NO/c1-11(21-16-7-6-13(17)8-15(16)19)9-20-10-12-4-2-3-5-14(12)18/h2-8,11,20H,9-10H2,1H3

Composition: C (55.76%), H (4.68%), Cl (30.86%), N (4.06%), O (4.64%)

Molar Mass: 344.66

Atom Count: 37

Heavy Atom Count: 21

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	1
Exact Mass	343.0297472
Formal Charge	0
FSP3	0.25
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
InChIKey	NIYICYTYFFZBBW-UHFFFAOYNA-N
Lipinski's Rule of Five
Molar Refractivity	88.69
Topological Polar Surface Area	21.26
Polarizability	35.12
Ring Count	2
Rotatable Bond Count	6

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