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1,5-dichloro-2-(1,1-difluoroethyl)-4-fluorobenzene

1,5-dichloro-2-(1,1-difluoroethyl)-4-fluorobenzene

CAS: 1138444-97-9

Formula: C8H5Cl2F3

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

IUPAC: 1,5-dichloro-2-(1,1-difluoroethyl)-4-fluorobenzene

InChI: InChI=1S/C8H5Cl2F3/c1-8(12,13)4-2-7(11)6(10)3-5(4)9/h2-3H,1H3

Composition: C (41.96%), H (2.20%), Cl (30.96%), F (24.89%)

Molar Mass: 229.02

Atom Count: 18

Heavy Atom Count: 13

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 227.9720401
Formal Charge 0
FSP3 0.25
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 0
Hydrogen Bond Donor Count 0
InChIKey HQGKIBKSWQSHAD-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 45.99
Topological Polar Surface Area 0
Polarizability 17.26
Ring Count 1
Rotatable Bond Count 1

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