bis(2-fluoro-4-methoxyphenyl)methanol

C15H14F2O3 — CID 102884350

IUPACbis(2-fluoro-4-methoxyphenyl)methanol
SMILESCOc1ccc(C(O)c2ccc(OC)cc2F)c(F)c1
InChIInChI=1S/C15H14F2O3/c1-19-9-3-5-11(13(16)7-9)15(18)12-6-4-10(20-2)8-14(12)17/h3-8,15,18H,1-2H3
InChIKeyPIEIZOVHHXVGDQ-UHFFFAOYSA-N
MW280.27 g/mol
LogP3.06
Rot. Bonds4

About bis(2-fluoro-4-methoxyphenyl)methanol

bis(2-fluoro-4-methoxyphenyl)methanol (PubChem CID 102884350) has the molecular formula C15H14F2O3 and a molecular weight of 280.27 g/mol. Its IUPAC name is bis(2-fluoro-4-methoxyphenyl)methanol.

Molecular Properties

Compound Namebis(2-fluoro-4-methoxyphenyl)methanol
PubChem CID102884350
Molecular FormulaC15H14F2O3
Molecular Weight280.27 g/mol
Exact Mass280.09
IUPAC Namebis(2-fluoro-4-methoxyphenyl)methanol
SMILESCOc1ccc(C(O)c2ccc(OC)cc2F)c(F)c1
InChIInChI=1S/C15H14F2O3/c1-19-9-3-5-11(13(16)7-9)15(18)12-6-4-10(20-2)8-14(12)17/h3-8,15,18H,1-2H3
InChIKeyPIEIZOVHHXVGDQ-UHFFFAOYSA-N
XLogP3.06
TPSA38.69 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.27
LogP ≤ 53.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of bis(2-fluoro-4-methoxyphenyl)methanol?
The IUPAC name of bis(2-fluoro-4-methoxyphenyl)methanol (CID 102884350) is bis(2-fluoro-4-methoxyphenyl)methanol.
What is the SMILES notation for bis(2-fluoro-4-methoxyphenyl)methanol?
The canonical SMILES for bis(2-fluoro-4-methoxyphenyl)methanol is COc1ccc(C(O)c2ccc(OC)cc2F)c(F)c1.
What is the InChIKey of bis(2-fluoro-4-methoxyphenyl)methanol?
The InChIKey is PIEIZOVHHXVGDQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14F2O3/c1-19-9-3-5-11(13(16)7-9)15(18)12-6-4-10(20-2)8-14(12)17/h3-8,15,18H,1-2H3.
What are the key properties of bis(2-fluoro-4-methoxyphenyl)methanol?
bis(2-fluoro-4-methoxyphenyl)methanol has a molecular weight of 280.27 g/mol, XLogP of 3.06, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for bis(2-fluoro-4-methoxyphenyl)methanol is sourced from PubChem (CID 102884350), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).