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1,2-dichloro-4-fluoro-3-(2,2,2-trifluoroethyl)benzene

1,2-dichloro-4-fluoro-3-(2,2,2-trifluoroethyl)benzene

Formula: C8H4Cl2F4

SMILES: FC1=C(CC(F)(F)F)C(Cl)=C(Cl)C=C1

IUPAC: 1,2-dichloro-4-fluoro-3-(2,2,2-trifluoroethyl)benzene

InChI: InChI=1S/C8H4Cl2F4/c9-5-1-2-6(11)4(7(5)10)3-8(12,13)14/h1-2H,3H2

Composition: C (38.90%), H (1.63%), Cl (28.70%), F (30.76%)

Molar Mass: 247.01

Atom Count: 18

Heavy Atom Count: 14

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 245.9626182
Formal Charge 0
FSP3 0.25
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 0
Hydrogen Bond Donor Count 0
InChIKey NSYMQHNTGPNRAL-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 46.31
Topological Polar Surface Area 0
Polarizability 17.17
Ring Count 1
Rotatable Bond Count 2

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Kinentia Biosciences LLC
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Purity LeadTime Formula PacketSize UnitPrice
95% <14 Days C8H4Cl2F4 $674.73$674.73
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