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4-chloro-6-(trifluoromethyl)pyrimidin-2-amine

4-chloro-6-(trifluoromethyl)pyrimidin-2-amine

CAS: 16097-60-2

Formula: C5H3ClF3N3

SMILES: NC1=NC(Cl)=CC(=N1)C(F)(F)F

IUPAC: 4-chloro-6-(trifluoromethyl)pyrimidin-2-amine

InChI: InChI=1S/C5H3ClF3N3/c6-3-1-2(5(7,8)9)11-4(10)12-3/h1H,(H2,10,11,12)

Composition: C (30.40%), H (1.53%), Cl (17.95%), F (28.85%), N (21.27%)

Molar Mass: 197.55

Atom Count: 15

Heavy Atom Count: 12

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 196.9967593
Formal Charge 0
FSP3 0.2
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 1
InChIKey ZLIUVGFJXHOHLN-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 38.84
Topological Polar Surface Area 51.8
Polarizability 13.24
Ring Count 1
Rotatable Bond Count 1

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95% <5 Days 16097-60-2 $517.00-$1,016.00$517.00$739.00$1,016.00
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