1-[4-[(2,4-difluorophenyl)methoxy]phenyl]ethanol

C15H14F2O2 — CID 62196202

IUPAC1-[4-[(2,4-difluorophenyl)methoxy]phenyl]ethanol
SMILESCC(O)c1ccc(OCc2ccc(F)cc2F)cc1
InChIInChI=1S/C15H14F2O2/c1-10(18)11-3-6-14(7-4-11)19-9-12-2-5-13(16)8-15(12)17/h2-8,10,18H,9H2,1H3
InChIKeyLFFDSPRVBDSMJN-UHFFFAOYSA-N
MW264.27 g/mol
LogP3.60
Rot. Bonds4

About 1-[4-[(2,4-difluorophenyl)methoxy]phenyl]ethanol

1-[4-[(2,4-difluorophenyl)methoxy]phenyl]ethanol (PubChem CID 62196202) has the molecular formula C15H14F2O2 and a molecular weight of 264.27 g/mol. Its IUPAC name is 1-[4-[(2,4-difluorophenyl)methoxy]phenyl]ethanol.

Molecular Properties

Compound Name1-[4-[(2,4-difluorophenyl)methoxy]phenyl]ethanol
PubChem CID62196202
Molecular FormulaC15H14F2O2
Molecular Weight264.27 g/mol
Exact Mass264.10
IUPAC Name1-[4-[(2,4-difluorophenyl)methoxy]phenyl]ethanol
SMILESCC(O)c1ccc(OCc2ccc(F)cc2F)cc1
InChIInChI=1S/C15H14F2O2/c1-10(18)11-3-6-14(7-4-11)19-9-12-2-5-13(16)8-15(12)17/h2-8,10,18H,9H2,1H3
InChIKeyLFFDSPRVBDSMJN-UHFFFAOYSA-N
XLogP3.60
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.27
LogP ≤ 53.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-[4-[(2,4-difluorophenyl)methoxy]phenyl]ethanol?
The IUPAC name of 1-[4-[(2,4-difluorophenyl)methoxy]phenyl]ethanol (CID 62196202) is 1-[4-[(2,4-difluorophenyl)methoxy]phenyl]ethanol.
What is the SMILES notation for 1-[4-[(2,4-difluorophenyl)methoxy]phenyl]ethanol?
The canonical SMILES for 1-[4-[(2,4-difluorophenyl)methoxy]phenyl]ethanol is CC(O)c1ccc(OCc2ccc(F)cc2F)cc1.
What is the InChIKey of 1-[4-[(2,4-difluorophenyl)methoxy]phenyl]ethanol?
The InChIKey is LFFDSPRVBDSMJN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14F2O2/c1-10(18)11-3-6-14(7-4-11)19-9-12-2-5-13(16)8-15(12)17/h2-8,10,18H,9H2,1H3.
What are the key properties of 1-[4-[(2,4-difluorophenyl)methoxy]phenyl]ethanol?
1-[4-[(2,4-difluorophenyl)methoxy]phenyl]ethanol has a molecular weight of 264.27 g/mol, XLogP of 3.60, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[4-[(2,4-difluorophenyl)methoxy]phenyl]ethanol is sourced from PubChem (CID 62196202), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).