4-(benzyloxy)-N-[(3-methylphenyl)methyl]aniline

4-(benzyloxy)-N-[(3-methylphenyl)methyl]aniline

CAS: 1040689-35-7

Formula: C21H21NO

SMILES: CC1=CC=CC(CNC2=CC=C(OCC3=CC=CC=C3)C=C2)=C1

IUPAC: 4-(benzyloxy)-N-[(3-methylphenyl)methyl]aniline

InChI: InChI=1S/C21H21NO/c1-17-6-5-9-19(14-17)15-22-20-10-12-21(13-11-20)23-16-18-7-3-2-4-8-18/h2-14,22H,15-16H2,1H3

Composition: C (83.13%), H (6.98%), N (4.62%), O (5.27%)

Molar Mass: 303.405

Atom Count: 44

Heavy Atom Count: 23

Properties

Properties

Common Names	N/A
Aromatic Ring Count	3
Asymmetric Atom Count	0
Exact Mass	303.1623143
Formal Charge	0
FSP3	0.14
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
InChIKey	NJASAWNICXGDJE-UHFFFAOYSA-N
Lipinski's Rule of Five
Molar Refractivity	96.98
Topological Polar Surface Area	21.26
Polarizability	36.85
Ring Count	3
Rotatable Bond Count	6

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