4-(3-tert-butylphenoxy)-3-methylaniline

4-(3-tert-butylphenoxy)-3-methylaniline

CAS: 946741-95-3

Formula: C17H21NO

SMILES: CC1=C(OC2=CC(=CC=C2)C(C)(C)C)C=CC(N)=C1

IUPAC: 4-(3-tert-butylphenoxy)-3-methylaniline

InChI: InChI=1S/C17H21NO/c1-12-10-14(18)8-9-16(12)19-15-7-5-6-13(11-15)17(2,3)4/h5-11H,18H2,1-4H3

Composition: C (79.96%), H (8.29%), N (5.49%), O (6.27%)

Molar Mass: 255.361

Atom Count: 40

Heavy Atom Count: 19

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	255.1623143
Formal Charge	0
FSP3	0.29
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	1
Hydrogen Bond Donor Count	1
InChIKey	AQANVBNGVZRPTO-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	80.71
Topological Polar Surface Area	35.25
Polarizability	30.89
Ring Count	2
Rotatable Bond Count	3

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