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4-fluorobenzoyl cyanide

4-fluorobenzoyl cyanide

CAS: 658-13-9

Formula: C8H4FNO

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

IUPAC: 4-fluorobenzoyl cyanide

InChI: InChI=1S/C8H4FNO/c9-7-3-1-6(2-4-7)8(11)5-10/h1-4H

Composition: C (64.43%), H (2.70%), F (12.74%), N (9.39%), O (10.73%)

Molar Mass: 149.124

Atom Count: 15

Heavy Atom Count: 11

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 149.027691916
Formal Charge 0
FSP3 0
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 0
InChIKey RYUDHPAOIWMELX-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 37.45
Topological Polar Surface Area 40.86
Polarizability 13.62
Ring Count 1
Rotatable Bond Count 1

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Purity (%)
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Purity LeadTime CAS PacketSize UnitPrice
95% <7 Days 658-13-9 $159.39-$260.82$159.39$260.82
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Purity LeadTime CAS PacketSize UnitPrice
96% <2 Days 658-13-9 $143.75-$4,597.70$143.75$171.35$227.70$342.70$1,370.80$4,597.70
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