[3,5-difluoro-4-[(2-fluoro-4-methoxyphenyl)methoxy]phenyl]methanol

C15H13F3O3 — CID 102877122

IUPAC[3,5-difluoro-4-[(2-fluoro-4-methoxyphenyl)methoxy]phenyl]methanol
SMILESCOc1ccc(COc2c(F)cc(CO)cc2F)c(F)c1
InChIInChI=1S/C15H13F3O3/c1-20-11-3-2-10(12(16)6-11)8-21-15-13(17)4-9(7-19)5-14(15)18/h2-6,19H,7-8H2,1H3
InChIKeyUHYHKBNREDZBRM-UHFFFAOYSA-N
MW298.26 g/mol
LogP3.18
Rot. Bonds5

About [3,5-difluoro-4-[(2-fluoro-4-methoxyphenyl)methoxy]phenyl]methanol

[3,5-difluoro-4-[(2-fluoro-4-methoxyphenyl)methoxy]phenyl]methanol (PubChem CID 102877122) has the molecular formula C15H13F3O3 and a molecular weight of 298.26 g/mol. Its IUPAC name is [3,5-difluoro-4-[(2-fluoro-4-methoxyphenyl)methoxy]phenyl]methanol.

Molecular Properties

Compound Name[3,5-difluoro-4-[(2-fluoro-4-methoxyphenyl)methoxy]phenyl]methanol
PubChem CID102877122
Molecular FormulaC15H13F3O3
Molecular Weight298.26 g/mol
Exact Mass298.08
IUPAC Name[3,5-difluoro-4-[(2-fluoro-4-methoxyphenyl)methoxy]phenyl]methanol
SMILESCOc1ccc(COc2c(F)cc(CO)cc2F)c(F)c1
InChIInChI=1S/C15H13F3O3/c1-20-11-3-2-10(12(16)6-11)8-21-15-13(17)4-9(7-19)5-14(15)18/h2-6,19H,7-8H2,1H3
InChIKeyUHYHKBNREDZBRM-UHFFFAOYSA-N
XLogP3.18
TPSA38.69 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.26
LogP ≤ 53.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

[3-fluoro-5-[(2-fluoro-4-methoxyphenyl)methoxy]phenyl]methanol
CID 102877142
2-fluoro-4-[(2-fluoro-4-methoxyphenyl)methoxy]benzoic acid
CID 107675360
2-fluoro-1-[(4-iodophenoxy)methyl]-4-methoxybenzene
CID 102876837
2-[(2-fluoro-4-methoxyphenyl)methoxy]phenol
CID 102877217
2-[4-[(2-fluoro-4-methoxyphenyl)methoxy]phenyl]ethanethioamide
CID 102876786
1-bromo-2-fluoro-4-[(2-fluoro-4-methoxyphenyl)methoxy]benzene
CID 102876842
4-[(2-fluoro-4-methoxyphenyl)methoxy]-N-methylaniline
CID 102878273
2-fluoro-6-[(2-fluoro-4-methoxyphenyl)methoxy]naphthalene
CID 139853874
1-bromo-3-(chloromethyl)-2-[(2-fluoro-4-methoxyphenyl)methoxy]benzene
CID 102877189
1-(chloromethyl)-2-[(2-fluoro-4-methoxyphenyl)methoxy]-3-methoxybenzene
CID 102877183
1-(bromomethyl)-2-[(2-fluoro-4-methoxyphenyl)methoxy]-3-methoxybenzene
CID 102877184
2-[(4-chloro-2-fluorophenyl)methoxy]-5-(chloromethyl)-1,3-difluorobenzene
CID 114850377

Frequently Asked Questions

What is the IUPAC name of [3,5-difluoro-4-[(2-fluoro-4-methoxyphenyl)methoxy]phenyl]methanol?
The IUPAC name of [3,5-difluoro-4-[(2-fluoro-4-methoxyphenyl)methoxy]phenyl]methanol (CID 102877122) is [3,5-difluoro-4-[(2-fluoro-4-methoxyphenyl)methoxy]phenyl]methanol.
What is the SMILES notation for [3,5-difluoro-4-[(2-fluoro-4-methoxyphenyl)methoxy]phenyl]methanol?
The canonical SMILES for [3,5-difluoro-4-[(2-fluoro-4-methoxyphenyl)methoxy]phenyl]methanol is COc1ccc(COc2c(F)cc(CO)cc2F)c(F)c1.
What is the InChIKey of [3,5-difluoro-4-[(2-fluoro-4-methoxyphenyl)methoxy]phenyl]methanol?
The InChIKey is UHYHKBNREDZBRM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13F3O3/c1-20-11-3-2-10(12(16)6-11)8-21-15-13(17)4-9(7-19)5-14(15)18/h2-6,19H,7-8H2,1H3.
What are the key properties of [3,5-difluoro-4-[(2-fluoro-4-methoxyphenyl)methoxy]phenyl]methanol?
[3,5-difluoro-4-[(2-fluoro-4-methoxyphenyl)methoxy]phenyl]methanol has a molecular weight of 298.26 g/mol, XLogP of 3.18, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [3,5-difluoro-4-[(2-fluoro-4-methoxyphenyl)methoxy]phenyl]methanol is sourced from PubChem (CID 102877122), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).