3-butoxy-N-[2-(4-methoxyphenoxy)propyl]aniline

3-butoxy-N-[2-(4-methoxyphenoxy)propyl]aniline

CAS: 1040683-21-3

Formula: C20H27NO3

SMILES: CCCCOC1=CC=CC(NCC(C)OC2=CC=C(OC)C=C2)=C1

IUPAC: 3-butoxy-N-[2-(4-methoxyphenoxy)propyl]aniline

InChI: InChI=1/C20H27NO3/c1-4-5-13-23-20-8-6-7-17(14-20)21-15-16(2)24-19-11-9-18(22-3)10-12-19/h6-12,14,16,21H,4-5,13,15H2,1-3H3

Composition: C (72.92%), H (8.26%), N (4.25%), O (14.57%)

Molar Mass: 329.44

Atom Count: 51

Heavy Atom Count: 24

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	1
Exact Mass	329.199093733
Formal Charge	0
FSP3	0.4
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	1
InChIKey	WOFLLZUGSBYOCQ-UHFFFAOYNA-N
Lipinski's Rule of Five	1
Molar Refractivity	98.02
Topological Polar Surface Area	39.72
Polarizability	37.83
Ring Count	2
Rotatable Bond Count	10

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