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1-chloro-2-(1,1-difluoroethyl)-4,5-difluorobenzene

1-chloro-2-(1,1-difluoroethyl)-4,5-difluorobenzene

CAS: 1138444-88-8

Formula: C8H5ClF4

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

IUPAC: 1-chloro-2-(1,1-difluoroethyl)-4,5-difluorobenzene

InChI: InChI=1S/C8H5ClF4/c1-8(12,13)4-2-6(10)7(11)3-5(4)9/h2-3H,1H3

Composition: C (45.20%), H (2.37%), Cl (16.68%), F (35.75%)

Molar Mass: 212.57

Atom Count: 18

Heavy Atom Count: 13

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 212.0015905
Formal Charge 0
FSP3 0.25
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 0
Hydrogen Bond Donor Count 0
InChIKey HTMMJPLXJLZKRK-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 41.4
Topological Polar Surface Area 0
Polarizability 15.15
Ring Count 1
Rotatable Bond Count 1

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