4-(4-benzylphenoxy)-3-chloroaniline

4-(4-benzylphenoxy)-3-chloroaniline

CAS: 84866-01-3

Formula: C19H16ClNO

SMILES: NC1=CC(Cl)=C(OC2=CC=C(CC3=CC=CC=C3)C=C2)C=C1

IUPAC: 4-(4-benzylphenoxy)-3-chloroaniline

InChI: InChI=1S/C19H16ClNO/c20-18-13-16(21)8-11-19(18)22-17-9-6-15(7-10-17)12-14-4-2-1-3-5-14/h1-11,13H,12,21H2

Composition: C (73.67%), H (5.21%), Cl (11.44%), N (4.52%), O (5.16%)

Molar Mass: 309.79

Atom Count: 38

Heavy Atom Count: 22

Properties

Properties

Common Names	N/A
Aromatic Ring Count	3
Asymmetric Atom Count	0
Exact Mass	309.0920418
Formal Charge	0
FSP3	0.05
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	1
Hydrogen Bond Donor Count	1
InChIKey	XZWSSGFMEFUZIR-UHFFFAOYSA-N
Lipinski's Rule of Five
Molar Refractivity	91.54
Topological Polar Surface Area	35.25
Polarizability	35.05
Ring Count	3
Rotatable Bond Count	4

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