[3-(2,3-difluorophenoxy)-5-fluorophenyl]methanol

C13H9F3O2 — CID 106530200

IUPAC[3-(2,3-difluorophenoxy)-5-fluorophenyl]methanol
SMILESOCc1cc(F)cc(Oc2cccc(F)c2F)c1
InChIInChI=1S/C13H9F3O2/c14-9-4-8(7-17)5-10(6-9)18-12-3-1-2-11(15)13(12)16/h1-6,17H,7H2
InChIKeyRNMLAQUHBOJYCS-UHFFFAOYSA-N
MW254.21 g/mol
LogP3.39
Rot. Bonds3

About [3-(2,3-difluorophenoxy)-5-fluorophenyl]methanol

[3-(2,3-difluorophenoxy)-5-fluorophenyl]methanol (PubChem CID 106530200) has the molecular formula C13H9F3O2 and a molecular weight of 254.21 g/mol. Its IUPAC name is [3-(2,3-difluorophenoxy)-5-fluorophenyl]methanol.

Molecular Properties

Compound Name[3-(2,3-difluorophenoxy)-5-fluorophenyl]methanol
PubChem CID106530200
Molecular FormulaC13H9F3O2
Molecular Weight254.21 g/mol
Exact Mass254.06
IUPAC Name[3-(2,3-difluorophenoxy)-5-fluorophenyl]methanol
SMILESOCc1cc(F)cc(Oc2cccc(F)c2F)c1
InChIInChI=1S/C13H9F3O2/c14-9-4-8(7-17)5-10(6-9)18-12-3-1-2-11(15)13(12)16/h1-6,17H,7H2
InChIKeyRNMLAQUHBOJYCS-UHFFFAOYSA-N
XLogP3.39
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.21
LogP ≤ 53.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

[3-fluoro-5-(5-fluoro-2-methylphenoxy)phenyl]methanol
CID 106530242
[3-(3-chlorophenoxy)-5-fluorophenyl]methanol
CID 106530131
[3-(2-butan-2-ylphenoxy)-5-fluorophenyl]methanol
CID 106530139
[3-fluoro-5-(2,4,5-trichlorophenoxy)phenyl]methanol
CID 106530101
2-[3-(3-chloro-2-fluorophenoxy)-5-fluorophenyl]ethanamine
CID 106533549
[4-(3,5-difluorophenoxy)-3-fluorophenyl]methanol
CID 55112239
[3-(4-ethyl-2-methoxyphenoxy)-5-fluorophenyl]methanol
CID 107665951
[3-(2-tert-butyl-4-methylphenoxy)-5-fluorophenyl]methanol
CID 106530108
[3-fluoro-4-(3-fluorophenoxy)phenyl]methanol
CID 28946122
(3-fluoro-5-methoxyphenyl)methanol
CID 26985456
[3-(3-fluorophenoxy)phenyl]methanol
CID 13255235
[4-(3-chloro-2-fluorophenoxy)-3,5-difluorophenyl]methanol
CID 116689370

Frequently Asked Questions

What is the IUPAC name of [3-(2,3-difluorophenoxy)-5-fluorophenyl]methanol?
The IUPAC name of [3-(2,3-difluorophenoxy)-5-fluorophenyl]methanol (CID 106530200) is [3-(2,3-difluorophenoxy)-5-fluorophenyl]methanol.
What is the SMILES notation for [3-(2,3-difluorophenoxy)-5-fluorophenyl]methanol?
The canonical SMILES for [3-(2,3-difluorophenoxy)-5-fluorophenyl]methanol is OCc1cc(F)cc(Oc2cccc(F)c2F)c1.
What is the InChIKey of [3-(2,3-difluorophenoxy)-5-fluorophenyl]methanol?
The InChIKey is RNMLAQUHBOJYCS-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H9F3O2/c14-9-4-8(7-17)5-10(6-9)18-12-3-1-2-11(15)13(12)16/h1-6,17H,7H2.
What are the key properties of [3-(2,3-difluorophenoxy)-5-fluorophenyl]methanol?
[3-(2,3-difluorophenoxy)-5-fluorophenyl]methanol has a molecular weight of 254.21 g/mol, XLogP of 3.39, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [3-(2,3-difluorophenoxy)-5-fluorophenyl]methanol is sourced from PubChem (CID 106530200), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).