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3',4-difluoro-[1,1'-biphenyl]-3,4'-dicarboxylic acid

3',4-difluoro-[1,1'-biphenyl]-3,4'-dicarboxylic acid

CAS: 1261956-34-6

Formula: C14H8F2O4

SMILES: OC(=O)C1=CC=C(C=C1F)C1=CC=C(F)C(=C1)C(O)=O

IUPAC: 3',4-difluoro-[1,1'-biphenyl]-3,4'-dicarboxylic acid

InChI: InChI=1S/C14H8F2O4/c15-11-4-2-7(5-10(11)14(19)20)8-1-3-9(13(17)18)12(16)6-8/h1-6H,(H,17,18)(H,19,20)

Composition: C (60.44%), H (2.90%), F (13.66%), O (23.00%)

Molar Mass: 278.211

Atom Count: 28

Heavy Atom Count: 20

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 0
Exact Mass 278.039065064
Formal Charge 0
FSP3 0
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 4
Hydrogen Bond Donor Count 2
InChIKey OIWAYUCBIWGOAN-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 66.14
Topological Polar Surface Area 74.6
Polarizability 25.36
Ring Count 2
Rotatable Bond Count 3

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Purity LeadTime CAS PacketSize UnitPrice
95% <6 Days 1261956-34-6 $626.75-$2,256.30$626.75$2,256.30
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