(1S)-1-[4-[(2,5-difluorophenyl)methoxy]phenyl]ethanol

C15H14F2O2 — CID 78930848

IUPAC(1S)-1-[4-[(2,5-difluorophenyl)methoxy]phenyl]ethanol
SMILESC[C@H](O)c1ccc(OCc2cc(F)ccc2F)cc1
InChIInChI=1S/C15H14F2O2/c1-10(18)11-2-5-14(6-3-11)19-9-12-8-13(16)4-7-15(12)17/h2-8,10,18H,9H2,1H3/t10-/m0/s1
InChIKeyUHEBFCIZYBXFGQ-JTQLQIEISA-N
MW264.27 g/mol
LogP3.60
Rot. Bonds4

About (1S)-1-[4-[(2,5-difluorophenyl)methoxy]phenyl]ethanol

(1S)-1-[4-[(2,5-difluorophenyl)methoxy]phenyl]ethanol (PubChem CID 78930848) has the molecular formula C15H14F2O2 and a molecular weight of 264.27 g/mol. Its IUPAC name is (1S)-1-[4-[(2,5-difluorophenyl)methoxy]phenyl]ethanol.

Molecular Properties

Compound Name(1S)-1-[4-[(2,5-difluorophenyl)methoxy]phenyl]ethanol
PubChem CID78930848
Molecular FormulaC15H14F2O2
Molecular Weight264.27 g/mol
Exact Mass264.10
IUPAC Name(1S)-1-[4-[(2,5-difluorophenyl)methoxy]phenyl]ethanol
SMILESC[C@H](O)c1ccc(OCc2cc(F)ccc2F)cc1
InChIInChI=1S/C15H14F2O2/c1-10(18)11-2-5-14(6-3-11)19-9-12-8-13(16)4-7-15(12)17/h2-8,10,18H,9H2,1H3/t10-/m0/s1
InChIKeyUHEBFCIZYBXFGQ-JTQLQIEISA-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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Related Compounds

1-[4-[(2,4-difluorophenyl)methoxy]phenyl]ethanol
CID 62196202
(1R)-1-[4-[(4-fluoro-2-methylphenyl)methoxy]phenyl]ethanol
CID 104894080
4-fluoro-3-[[4-[(1R)-1-hydroxyethyl]phenoxy]methyl]benzonitrile
CID 78930543
(1R)-1-[4-[(4-chloro-2-fluorophenyl)methoxy]phenyl]ethanol
CID 104980144
2-[1-[4-[(2,5-difluorophenyl)methoxy]phenyl]ethoxy]acetic acid
CID 71294679
(1R)-1-[4-[(4-fluorophenyl)methoxy]phenyl]ethanol
CID 63364366
1-[4-[(5-chloro-2-methoxyphenyl)methoxy]phenyl]ethanol
CID 43424347
(1S)-1-[4-[(2-methoxyphenyl)methoxy]phenyl]ethanol
CID 78930283
(1S)-1-[4-[(3-bromo-4-fluorophenyl)methoxy]phenyl]ethanol
CID 78930231
1-[4-[(3-fluoro-4-methoxyphenyl)methoxy]phenyl]ethanol
CID 43503631
potassium [4-[(2,5-difluorophenyl)methoxy]phenyl]-trifluoroboranuide
CID 63678052
4-fluoro-3-[(4-propan-2-ylphenoxy)methyl]benzoic acid
CID 63530478

Frequently Asked Questions

What is the IUPAC name of (1S)-1-[4-[(2,5-difluorophenyl)methoxy]phenyl]ethanol?
The IUPAC name of (1S)-1-[4-[(2,5-difluorophenyl)methoxy]phenyl]ethanol (CID 78930848) is (1S)-1-[4-[(2,5-difluorophenyl)methoxy]phenyl]ethanol.
What is the SMILES notation for (1S)-1-[4-[(2,5-difluorophenyl)methoxy]phenyl]ethanol?
The canonical SMILES for (1S)-1-[4-[(2,5-difluorophenyl)methoxy]phenyl]ethanol is C[C@H](O)c1ccc(OCc2cc(F)ccc2F)cc1.
What is the InChIKey of (1S)-1-[4-[(2,5-difluorophenyl)methoxy]phenyl]ethanol?
The InChIKey is UHEBFCIZYBXFGQ-JTQLQIEISA-N. The full InChI is InChI=1S/C15H14F2O2/c1-10(18)11-2-5-14(6-3-11)19-9-12-8-13(16)4-7-15(12)17/h2-8,10,18H,9H2,1H3/t10-/m0/s1.
What are the key properties of (1S)-1-[4-[(2,5-difluorophenyl)methoxy]phenyl]ethanol?
(1S)-1-[4-[(2,5-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 (1S)-1-[4-[(2,5-difluorophenyl)methoxy]phenyl]ethanol is sourced from PubChem (CID 78930848), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).