methyl 2,4'-difluoro-3'-methoxy-[1,1'-biphenyl]-3-carboxylate

methyl 2,4'-difluoro-3'-methoxy-[1,1'-biphenyl]-3-carboxylate

CAS: 1381944-46-2

Formula: C15H12F2O3

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

IUPAC: methyl 2,4'-difluoro-3'-methoxy-[1,1'-biphenyl]-3-carboxylate

InChI: InChI=1S/C15H12F2O3/c1-19-13-8-9(6-7-12(13)16)10-4-3-5-11(14(10)17)15(18)20-2/h3-8H,1-2H3

Composition: C (64.75%), H (4.35%), F (13.66%), O (17.25%)

Molar Mass: 278.255

Atom Count: 32

Heavy Atom Count: 20

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	278.075450572
Formal Charge	0
FSP3	0.13
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
InChIKey	HVAVCEGCGIXFDJ-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	70.12
Topological Polar Surface Area	35.53
Polarizability	27.55
Ring Count	2
Rotatable Bond Count	4

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