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4-(1-fluoroethyl)pyrimidine-5-carbonitrile

4-(1-fluoroethyl)pyrimidine-5-carbonitrile

CAS: 1427195-36-5

Formula: C7H6FN3

SMILES: CC(F)C1=NC=NC=C1C#N

IUPAC: 4-(1-fluoroethyl)pyrimidine-5-carbonitrile

InChI: InChI=1/C7H6FN3/c1-5(8)7-6(2-9)3-10-4-11-7/h3-5H,1H3

Composition: C (55.63%), H (4.00%), F (12.57%), N (27.80%)

Molar Mass: 151.144

Atom Count: 17

Heavy Atom Count: 11

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 1
Exact Mass 151.054575368
Formal Charge 0
FSP3 0.29
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 0
InChIKey FCDHRGKSQHCMCV-UHFFFAOYNA-N
Lipinski's Rule of Five 1
Molar Refractivity 37.54
Topological Polar Surface Area 49.57
Polarizability 13.82
Ring Count 1
Rotatable Bond Count 1

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98% <2 Days 1427195-36-5 $1,147.70-$4,597.70$1,147.70$4,597.70
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