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2-(dimethylamino)-6-fluorobenzonitrile

2-(dimethylamino)-6-fluorobenzonitrile

CAS: 96994-73-9

Formula: C9H9FN2

SMILES: CN(C)C1=C(C#N)C(F)=CC=C1

IUPAC: 2-(dimethylamino)-6-fluorobenzonitrile

InChI: InChI=1S/C9H9FN2/c1-12(2)9-5-3-4-8(10)7(9)6-11/h3-5H,1-2H3

Composition: C (65.84%), H (5.53%), F (11.57%), N (17.06%)

Molar Mass: 164.183

Atom Count: 21

Heavy Atom Count: 12

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 164.074976461
Formal Charge 0
FSP3 0.22
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 0
InChIKey WWNKVUULRIWDJZ-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 46.42
Topological Polar Surface Area 27.03
Polarizability 16.65
Ring Count 1
Rotatable Bond Count 1

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95% <5 Days 96994-73-9 $600.00-$6,048.00$600.00$2,200.00$6,048.00
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