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5-ethynyl-2-fluorobenzonitrile

5-ethynyl-2-fluorobenzonitrile

Formula: C9H4FN

SMILES: FC1=C(C=C(C=C1)C#C)C#N

IUPAC: 5-ethynyl-2-fluorobenzonitrile

InChI: InChI=1S/C9H4FN/c1-2-7-3-4-9(10)8(5-7)6-11/h1,3-5H

Composition: C (74.48%), H (2.78%), F (13.09%), N (9.65%)

Molar Mass: 145.136

Atom Count: 15

Heavy Atom Count: 11

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 145.032777296
Formal Charge 0
FSP3 0
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 1
Hydrogen Bond Donor Count 0
InChIKey HMYHIKAXGAPRJL-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 37.17
Topological Polar Surface Area 23.79
Polarizability 14.4
Ring Count 1
Rotatable Bond Count 0

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Purity (%)
-
Ships Within
Days
Packet Size
Molecule Market Select
Purity LeadTime Formula UnitPrice
98% <10 Days C9H4FN Quote Only