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3,3,3-trifluoro-2-(4-fluorophenyl)-2-hydroxypropanoic acid

3,3,3-trifluoro-2-(4-fluorophenyl)-2-hydroxypropanoic acid

Formula: C9H6F4O3

SMILES: OC(=O)C(O)(C1=CC=C(F)C=C1)C(F)(F)F

IUPAC: 3,3,3-trifluoro-2-(4-fluorophenyl)-2-hydroxypropanoic acid

InChI: InChI=1/C9H6F4O3/c10-6-3-1-5(2-4-6)8(16,7(14)15)9(11,12)13/h1-4,16H,(H,14,15)

Composition: C (45.39%), H (2.54%), F (31.91%), O (20.16%)

Molar Mass: 238.138

Atom Count: 22

Heavy Atom Count: 16

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 1
Exact Mass 238.025306705
Formal Charge 0
FSP3 0.22
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 2
InChIKey GCFATYHCFDGXEH-UHFFFAOYNA-N
Lipinski's Rule of Five 1
Molar Refractivity 44.33
Topological Polar Surface Area 57.53
Polarizability 16.52
Ring Count 1
Rotatable Bond Count 3

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Kinentia Biosciences LLC
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Purity LeadTime Formula PacketSize UnitPrice
95% <14 Days C9H6F4O3 $340.20$340.20
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