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1-chloro-2,4-difluoro-3-methoxybenzene

1-chloro-2,4-difluoro-3-methoxybenzene

CAS: 261762-38-3

Formula: C7H5ClF2O

SMILES: COC1=C(F)C=CC(Cl)=C1F

IUPAC: 1-chloro-2,4-difluoro-3-methoxybenzene

InChI: InChI=1S/C7H5ClF2O/c1-11-7-5(9)3-2-4(8)6(7)10/h2-3H,1H3

Composition: C (47.09%), H (2.82%), Cl (19.85%), F (21.28%), O (8.96%)

Molar Mass: 178.56

Atom Count: 16

Heavy Atom Count: 11

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 177.9996988
Formal Charge 0
FSP3 0.14
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 1
Hydrogen Bond Donor Count 0
InChIKey DYTKOWZSDUEQBQ-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 37.76
Topological Polar Surface Area 9.23
Polarizability 14.31
Ring Count 1
Rotatable Bond Count 1

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