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2-fluoro-3'-methyl-[1,1'-biphenyl]-4-carboxylic acid

2-fluoro-3'-methyl-[1,1'-biphenyl]-4-carboxylic acid

CAS: 1261993-08-1

Formula: C14H11FO2

SMILES: CC1=CC=CC(=C1)C1=CC=C(C=C1F)C(O)=O

IUPAC: 2-fluoro-3'-methyl-[1,1'-biphenyl]-4-carboxylic acid

InChI: InChI=1S/C14H11FO2/c1-9-3-2-4-10(7-9)12-6-5-11(14(16)17)8-13(12)15/h2-8H,1H3,(H,16,17)

Composition: C (73.03%), H (4.82%), F (8.25%), O (13.90%)

Molar Mass: 230.238

Atom Count: 28

Heavy Atom Count: 17

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 0
Exact Mass 230.074307757
Formal Charge 0
FSP3 0.07
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 1
InChIKey RWEMRZDXBYIYDX-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 63.71
Topological Polar Surface Area 37.3
Polarizability 25.01
Ring Count 2
Rotatable Bond Count 2

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Purity (%)
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AA BLOCKS INC
Purity LeadTime CAS PacketSize UnitPrice
98% <6 Days 1261993-08-1 $491.05-$1,330.55$491.05$1,033.85$1,330.55
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