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6-amino-4-(trifluoromethyl)pyridine-3-carbonitrile

6-amino-4-(trifluoromethyl)pyridine-3-carbonitrile

CAS: 1260382-03-3

Formula: C7H4F3N3

SMILES: NC1=CC(=C(C=N1)C#N)C(F)(F)F

IUPAC: 6-amino-4-(trifluoromethyl)pyridine-3-carbonitrile

InChI: InChI=1S/C7H4F3N3/c8-7(9,10)5-1-6(12)13-3-4(5)2-11/h1,3H,(H2,12,13)

Composition: C (44.93%), H (2.15%), F (30.46%), N (22.46%)

Molar Mass: 187.125

Atom Count: 17

Heavy Atom Count: 13

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 187.03573163
Formal Charge 0
FSP3 0.14
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 1
InChIKey YVJZAZKQEXQQNY-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 40.61
Topological Polar Surface Area 62.7
Polarizability 13.77
Ring Count 1
Rotatable Bond Count 1

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Purity LeadTime CAS PacketSize UnitPrice
95% <2 Days 1260382-03-3 $339.25-$1,006.25$339.25$488.75$1,006.25
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