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1,2,4,5-tetrafluoro-3-methoxy-6-methylbenzene

1,2,4,5-tetrafluoro-3-methoxy-6-methylbenzene

CAS: 3150-40-1

Formula: C8H6F4O

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

IUPAC: 1,2,4,5-tetrafluoro-3-methoxy-6-methylbenzene

InChI: InChI=1S/C8H6F4O/c1-3-4(9)6(11)8(13-2)7(12)5(3)10/h1-2H3

Composition: C (49.50%), H (3.12%), F (39.15%), O (8.24%)

Molar Mass: 194.129

Atom Count: 19

Heavy Atom Count: 13

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 194.035477465
Formal Charge 0
FSP3 0.25
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 1
Hydrogen Bond Donor Count 0
InChIKey SQYHXODAPWFHAZ-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 38.43
Topological Polar Surface Area 9.23
Polarizability 13.82
Ring Count 1
Rotatable Bond Count 1

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