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5-bromo-2,4-difluoro-3-(triethylsilyl)benzoic acid

5-bromo-2,4-difluoro-3-(triethylsilyl)benzoic acid

Formula: C13H17BrF2O2Si

SMILES: CC[Si](CC)(CC)C1=C(F)C(=CC(Br)=C1F)C(O)=O

IUPAC: 5-bromo-2,4-difluoro-3-(triethylsilyl)benzoic acid

InChI: InChI=1S/C13H17BrF2O2Si/c1-4-19(5-2,6-3)12-10(15)8(13(17)18)7-9(14)11(12)16/h7H,4-6H2,1-3H3,(H,17,18)

Composition: C (44.45%), H (4.88%), Br (22.75%), F (10.82%), O (9.11%), Si (8.00%)

Molar Mass: 351.263

Atom Count: 36

Heavy Atom Count: 19

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 350.014926
Formal Charge 0
FSP3 0.46
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 1
InChIKey LQBBJZZTWZOWEA-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 71.83
Topological Polar Surface Area 37.3
Polarizability 29.04
Ring Count 1
Rotatable Bond Count 5

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Purity LeadTime Formula UnitPrice
98% <10 Days C13H17BrF2O2Si Quote Only