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2-(4-methoxyphenoxy)benzonitrile

2-(4-methoxyphenoxy)benzonitrile

CAS: 171771-88-3

Formula: C14H11NO2

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

IUPAC: 2-(4-methoxyphenoxy)benzonitrile

InChI: InChI=1S/C14H11NO2/c1-16-12-6-8-13(9-7-12)17-14-5-3-2-4-11(14)10-15/h2-9H,1H3

Composition: C (74.65%), H (4.92%), N (6.22%), O (14.21%)

Molar Mass: 225.247

Atom Count: 28

Heavy Atom Count: 17

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 0
Exact Mass 225.078978598
Formal Charge 0
FSP3 0.07
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 0
InChIKey POUCYJIZEHTDSO-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 64.48
Topological Polar Surface Area 42.25
Polarizability 25.01
Ring Count 2
Rotatable Bond Count 3

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Purity LeadTime CAS PacketSize UnitPrice
95% <2 Days 171771-88-3 $51.35-$539.70$51.35$63.37$86.31$113.62$180.26$539.70
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