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3-chloro-2-[8-chloro-6-(trifluoromethyl)imidazo[1,5-a]pyridin-3-yl]-5-(trifluoromethyl)pyridine

3-chloro-2-[8-chloro-6-(trifluoromethyl)imidazo[1,5-a]pyridin-3-yl]-5-(trifluoromethyl)pyridine

CAS: 338419-98-0

Formula: C14H5Cl2F6N3

SMILES: FC(F)(F)C1=CC(Cl)=C(N=C1)C1=NC=C2N1C=C(C=C2Cl)C(F)(F)F

IUPAC: 3-chloro-2-[8-chloro-6-(trifluoromethyl)imidazo[1,5-a]pyridin-3-yl]-5-(trifluoromethyl)pyridine

InChI: InChI=1S/C14H5Cl2F6N3/c15-8-2-7(14(20,21)22)5-25-10(8)4-24-12(25)11-9(16)1-6(3-23-11)13(17,18)19/h1-5H

Composition: C (42.03%), H (1.26%), Cl (17.72%), F (28.49%), N (10.50%)

Molar Mass: 400.11

Atom Count: 30

Heavy Atom Count: 25

Properties
Properties
Common Names N/A
Aromatic Ring Count 3
Asymmetric Atom Count 0
Exact Mass 398.9764716
Formal Charge 0
FSP3 0.14
Hetero Ring Count 3
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 0
InChIKey IHHHAPIBCVRCBK-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 90.47
Topological Polar Surface Area 30.19
Polarizability 29.77
Ring Count 3
Rotatable Bond Count 3

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Purity LeadTime CAS PacketSize UnitPrice
90% <2 Days 338419-98-0 $51.35-$86.31$51.35$63.37$86.31
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