2-butoxy-N-{[2-(2-ethoxyethoxy)phenyl]methyl}aniline

2-butoxy-N-{[2-(2-ethoxyethoxy)phenyl]methyl}aniline

CAS: 1040689-71-1

Formula: C21H29NO3

SMILES: CCCCOC1=C(NCC2=C(OCCOCC)C=CC=C2)C=CC=C1

IUPAC: 2-butoxy-N-{[2-(2-ethoxyethoxy)phenyl]methyl}aniline

InChI: InChI=1S/C21H29NO3/c1-3-5-14-24-21-13-9-7-11-19(21)22-17-18-10-6-8-12-20(18)25-16-15-23-4-2/h6-13,22H,3-5,14-17H2,1-2H3

Composition: C (73.44%), H (8.51%), N (4.08%), O (13.97%)

Molar Mass: 343.467

Atom Count: 54

Heavy Atom Count: 25

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	343.214743798
Formal Charge	0
FSP3	0.43
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	1
InChIKey	UWZSUHXYVRGWJQ-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	103.46
Topological Polar Surface Area	39.72
Polarizability	39.69
Ring Count	2
Rotatable Bond Count	12

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