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2-{2-fluoro-[1,1'-biphenyl]-4-yl}-2-hydroxypropanoic acid

2-{2-fluoro-[1,1'-biphenyl]-4-yl}-2-hydroxypropanoic acid

CAS: 61466-95-3

Formula: C15H13FO3

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

IUPAC: 2-{2-fluoro-[1,1'-biphenyl]-4-yl}-2-hydroxypropanoic acid

InChI: InChI=1/C15H13FO3/c1-15(19,14(17)18)11-7-8-12(13(16)9-11)10-5-3-2-4-6-10/h2-9,19H,1H3,(H,17,18)

Composition: C (69.22%), H (5.03%), F (7.30%), O (18.44%)

Molar Mass: 260.264

Atom Count: 32

Heavy Atom Count: 19

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 1
Exact Mass 260.084872442
Formal Charge 0
FSP3 0.13
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 2
InChIKey WZESXUMKHKBMLE-UHFFFAOYNA-N
Lipinski's Rule of Five 1
Molar Refractivity 68.77
Topological Polar Surface Area 57.53
Polarizability 27.57
Ring Count 2
Rotatable Bond Count 3

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Purity LeadTime CAS PacketSize UnitPrice
97% <5 Days 61466-95-3 $148.80-$685.98$148.80$174.02$282.46$685.98
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