3-chloro-N-[2-(4-methoxyphenoxy)ethyl]-4-methylaniline

3-chloro-N-[2-(4-methoxyphenoxy)ethyl]-4-methylaniline

CAS: 1040681-36-4

Formula: C16H18ClNO2

SMILES: COC1=CC=C(OCCNC2=CC(Cl)=C(C)C=C2)C=C1

IUPAC: 3-chloro-N-[2-(4-methoxyphenoxy)ethyl]-4-methylaniline

InChI: InChI=1S/C16H18ClNO2/c1-12-3-4-13(11-16(12)17)18-9-10-20-15-7-5-14(19-2)6-8-15/h3-8,11,18H,9-10H2,1-2H3

Composition: C (65.86%), H (6.22%), Cl (12.15%), N (4.80%), O (10.97%)

Molar Mass: 291.78

Atom Count: 38

Heavy Atom Count: 20

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	291.1026065
Formal Charge	0
FSP3	0.25
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
InChIKey	VTFNBUXBUGZSOI-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	83.11
Topological Polar Surface Area	30.49
Polarizability	31.56
Ring Count	2
Rotatable Bond Count	6

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