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4-(2,4-difluorophenoxy)-2-methylaniline

4-(2,4-difluorophenoxy)-2-methylaniline

CAS: 946664-75-1

Formula: C13H11F2NO

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

IUPAC: 4-(2,4-difluorophenoxy)-2-methylaniline

InChI: InChI=1S/C13H11F2NO/c1-8-6-10(3-4-12(8)16)17-13-5-2-9(14)7-11(13)15/h2-7H,16H2,1H3

Composition: C (66.38%), H (4.71%), F (16.15%), N (5.95%), O (6.80%)

Molar Mass: 235.234

Atom Count: 28

Heavy Atom Count: 17

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 0
Exact Mass 235.080870304
Formal Charge 0
FSP3 0.08
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 1
Hydrogen Bond Donor Count 1
InChIKey DTDRZXJNMCVAEU-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 62.47
Topological Polar Surface Area 35.25
Polarizability 22.91
Ring Count 2
Rotatable Bond Count 2

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