4'-fluoro-3'-methoxy-[1,1'-biphenyl]-3-carbonitrile

4'-fluoro-3'-methoxy-[1,1'-biphenyl]-3-carbonitrile

CAS: 1365271-56-2

Formula: C14H10FNO

SMILES: COC1=CC(=CC=C1F)C1=CC(=CC=C1)C#N

IUPAC: 4'-fluoro-3'-methoxy-[1,1'-biphenyl]-3-carbonitrile

InChI: InChI=1S/C14H10FNO/c1-17-14-8-12(5-6-13(14)15)11-4-2-3-10(7-11)9-16/h2-8H,1H3

Composition: C (74.00%), H (4.44%), F (8.36%), N (6.16%), O (7.04%)

Molar Mass: 227.238

Atom Count: 27

Heavy Atom Count: 17

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	227.074642109
Formal Charge	0
FSP3	0.07
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
InChIKey	VMTQTSKLMGAZFS-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	63.6
Topological Polar Surface Area	33.02
Polarizability	25.27
Ring Count	2
Rotatable Bond Count	2

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