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4-methoxy-3-methylpyridine-2-carbonitrile

4-methoxy-3-methylpyridine-2-carbonitrile

CAS: 886372-21-0

Formula: C8H8N2O

SMILES: COC1=CC=NC(C#N)=C1C

IUPAC: 4-methoxy-3-methylpyridine-2-carbonitrile

InChI: InChI=1S/C8H8N2O/c1-6-7(5-9)10-4-3-8(6)11-2/h3-4H,1-2H3

Composition: C (64.85%), H (5.44%), N (18.91%), O (10.80%)

Molar Mass: 148.165

Atom Count: 19

Heavy Atom Count: 11

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 148.063662886
Formal Charge 0
FSP3 0.25
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 0
InChIKey PBUYPSKEEQASED-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 40.76
Topological Polar Surface Area 45.91
Polarizability 15.55
Ring Count 1
Rotatable Bond Count 1

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97% <2 Days 886372-21-0 $179.40-$4,597.70$179.40$243.80$373.75$631.35$1,147.70$4,597.70
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