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3-fluoro-4-(4-methoxyphenoxy)aniline

3-fluoro-4-(4-methoxyphenoxy)aniline

CAS: 87294-20-0

Formula: C13H12FNO2

SMILES: COC1=CC=C(OC2=C(F)C=C(N)C=C2)C=C1

IUPAC: 3-fluoro-4-(4-methoxyphenoxy)aniline

InChI: InChI=1S/C13H12FNO2/c1-16-10-3-5-11(6-4-10)17-13-7-2-9(15)8-12(13)14/h2-8H,15H2,1H3

Composition: C (66.94%), H (5.19%), F (8.15%), N (6.01%), O (13.72%)

Molar Mass: 233.242

Atom Count: 29

Heavy Atom Count: 17

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 0
Exact Mass 233.085206793
Formal Charge 0
FSP3 0.08
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 1
InChIKey PCZUUFORWUUPJP-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 63.68
Topological Polar Surface Area 44.48
Polarizability 23.97
Ring Count 2
Rotatable Bond Count 3

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Purity LeadTime CAS PacketSize UnitPrice
95% <2 Days 87294-20-0 $219.25$219.25
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