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3-[(3-fluorophenyl)methoxy]-4-methoxybenzaldehyde

3-[(3-fluorophenyl)methoxy]-4-methoxybenzaldehyde

CAS: 346459-53-8

Formula: C15H13FO3

SMILES: COC1=C(OCC2=CC(F)=CC=C2)C=C(C=O)C=C1

IUPAC: 3-[(3-fluorophenyl)methoxy]-4-methoxybenzaldehyde

InChI: InChI=1S/C15H13FO3/c1-18-14-6-5-11(9-17)8-15(14)19-10-12-3-2-4-13(16)7-12/h2-9H,10H2,1H3

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 0
Exact Mass 260.084872442
Formal Charge 0
FSP3 0.13
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 0
InChIKey MELWMTALSAOIPU-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 70.4
Topological Polar Surface Area 35.53
Polarizability 26.52
Ring Count 2
Rotatable Bond Count 5

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