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N-(prop-2-yn-1-yl)aniline

N-(prop-2-yn-1-yl)aniline

CAS: 14465-74-8

Formula: C9H9N

SMILES: C#CCNC1=CC=CC=C1

IUPAC: N-(prop-2-yn-1-yl)aniline

InChI: InChI=1S/C9H9N/c1-2-8-10-9-6-4-3-5-7-9/h1,3-7,10H,8H2

Composition: C (82.41%), H (6.92%), N (10.68%)

Molar Mass: 131.178

Atom Count: 19

Heavy Atom Count: 10

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 131.073499294
Formal Charge 0
FSP3 0.11
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 1
Hydrogen Bond Donor Count 1
InChIKey IZKIWEYIOKPHLF-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 43.83
Topological Polar Surface Area 12.03
Polarizability 15.93
Ring Count 1
Rotatable Bond Count 2

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Purity LeadTime CAS PacketSize UnitPrice
% <6 Days 14465-74-8 $417.45-$1,538.70$417.45$474.95$532.45$603.75$1,538.70
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