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3-methyl-2-(2-methylpropoxy)aniline

3-methyl-2-(2-methylpropoxy)aniline

CAS: 1375069-03-6

Formula: C11H17NO

SMILES: CC(C)COC1=C(C)C=CC=C1N

IUPAC: 3-methyl-2-(2-methylpropoxy)aniline

InChI: InChI=1S/C11H17NO/c1-8(2)7-13-11-9(3)5-4-6-10(11)12/h4-6,8H,7,12H2,1-3H3

Composition: C (73.70%), H (9.56%), N (7.81%), O (8.92%)

Molar Mass: 179.263

Atom Count: 30

Heavy Atom Count: 13

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 179.131014171
Formal Charge 0
FSP3 0.45
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 1
InChIKey MCJJKFPXMTVJBY-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 56.01
Topological Polar Surface Area 35.25
Polarizability 21.29
Ring Count 1
Rotatable Bond Count 3

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