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4-[2-(4-aminophenyl)ethynyl]aniline

4-[2-(4-aminophenyl)ethynyl]aniline

CAS: 6052-15-9

Formula: C14H12N2

SMILES: NC1=CC=C(C=C1)C#CC1=CC=C(N)C=C1

IUPAC: 4-[2-(4-aminophenyl)ethynyl]aniline

InChI: InChI=1S/C14H12N2/c15-13-7-3-11(4-8-13)1-2-12-5-9-14(16)10-6-12/h3-10H,15-16H2

Composition: C (80.74%), H (5.81%), N (13.45%)

Molar Mass: 208.264

Atom Count: 28

Heavy Atom Count: 16

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 0
Exact Mass 208.100048394
Formal Charge 0
FSP3 0
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 2
InChIKey WAUKJWLKPXRNKT-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 63.3
Topological Polar Surface Area 52.04
Polarizability 24.81
Ring Count 2
Rotatable Bond Count 2

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Purity LeadTime CAS PacketSize UnitPrice
95% <5 Days 6052-15-9 $52.96-$214.37$52.96$70.62$214.37
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