1-fluoro-4-methoxy-2-phenoxybenzene

C13H11FO2 — CID 162127309

IUPAC1-fluoro-4-methoxy-2-phenoxybenzene
SMILESCOc1ccc(F)c(Oc2ccccc2)c1
InChIInChI=1S/C13H11FO2/c1-15-11-7-8-12(14)13(9-11)16-10-5-3-2-4-6-10/h2-9H,1H3
InChIKeyIUBSGTYOIYMHQH-UHFFFAOYSA-N
MW218.23 g/mol
LogP3.63
Rot. Bonds3

About 1-fluoro-4-methoxy-2-phenoxybenzene

1-fluoro-4-methoxy-2-phenoxybenzene (PubChem CID 162127309) has the molecular formula C13H11FO2 and a molecular weight of 218.23 g/mol. Its IUPAC name is 1-fluoro-4-methoxy-2-phenoxybenzene.

Molecular Properties

Compound Name1-fluoro-4-methoxy-2-phenoxybenzene
PubChem CID162127309
Molecular FormulaC13H11FO2
Molecular Weight218.23 g/mol
Exact Mass218.07
IUPAC Name1-fluoro-4-methoxy-2-phenoxybenzene
SMILESCOc1ccc(F)c(Oc2ccccc2)c1
InChIInChI=1S/C13H11FO2/c1-15-11-7-8-12(14)13(9-11)16-10-5-3-2-4-6-10/h2-9H,1H3
InChIKeyIUBSGTYOIYMHQH-UHFFFAOYSA-N
XLogP3.63
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.23
LogP ≤ 53.63
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

1,4-dimethoxy-2-phenoxybenzene;molecular nitrogen
CID 70565966
1-tert-butyl-4-methoxy-2-phenoxybenzene
CID 143202933
ethane;1-fluoro-2-phenoxybenzene
CID 170962676
2-bromo-1-fluoro-4-phenoxybenzene
CID 71774083
4-fluoro-3-(4-phenoxyphenoxy)benzaldehyde
CID 13368776
2-fluoro-1-(4-fluorophenoxy)-4-methoxybenzene
CID 174755555
bis(4-fluoro-3-phenoxyphenyl)methanone
CID 67872405
anisole;1,2-difluorobenzene
CID 158594805
2-(4-fluoro-3-phenoxyphenyl)ethanamine
CID 170887829
2-[4-fluoro-3-(4-methoxyphenoxy)phenyl]acetonitrile
CID 54073521
1,4-dimethoxy-2-(3-methoxyphenoxy)benzene
CID 95561214
1-fluoro-2-[3-[4-[4-[3-(2-fluorophenoxy)phenoxy]phenoxy]phenoxy]phenoxy]benzene
CID 22338576

Frequently Asked Questions

What is the IUPAC name of 1-fluoro-4-methoxy-2-phenoxybenzene?
The IUPAC name of 1-fluoro-4-methoxy-2-phenoxybenzene (CID 162127309) is 1-fluoro-4-methoxy-2-phenoxybenzene.
What is the SMILES notation for 1-fluoro-4-methoxy-2-phenoxybenzene?
The canonical SMILES for 1-fluoro-4-methoxy-2-phenoxybenzene is COc1ccc(F)c(Oc2ccccc2)c1.
What is the InChIKey of 1-fluoro-4-methoxy-2-phenoxybenzene?
The InChIKey is IUBSGTYOIYMHQH-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H11FO2/c1-15-11-7-8-12(14)13(9-11)16-10-5-3-2-4-6-10/h2-9H,1H3.
What are the key properties of 1-fluoro-4-methoxy-2-phenoxybenzene?
1-fluoro-4-methoxy-2-phenoxybenzene has a molecular weight of 218.23 g/mol, XLogP of 3.63, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-fluoro-4-methoxy-2-phenoxybenzene is sourced from PubChem (CID 162127309), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).