4-[[2-fluoro-6-(hydroxymethyl)phenoxy]methyl]phenol

C14H13FO3 — CID 112613126

IUPAC4-[[2-fluoro-6-(hydroxymethyl)phenoxy]methyl]phenol
SMILESOCc1cccc(F)c1OCc1ccc(O)cc1
InChIInChI=1S/C14H13FO3/c15-13-3-1-2-11(8-16)14(13)18-9-10-4-6-12(17)7-5-10/h1-7,16-17H,8-9H2
InChIKeyFYWRGOICMVPXLW-UHFFFAOYSA-N
MW248.25 g/mol
LogP2.60
Rot. Bonds4

About 4-[[2-fluoro-6-(hydroxymethyl)phenoxy]methyl]phenol

4-[[2-fluoro-6-(hydroxymethyl)phenoxy]methyl]phenol (PubChem CID 112613126) has the molecular formula C14H13FO3 and a molecular weight of 248.25 g/mol. Its IUPAC name is 4-[[2-fluoro-6-(hydroxymethyl)phenoxy]methyl]phenol.

Molecular Properties

Compound Name4-[[2-fluoro-6-(hydroxymethyl)phenoxy]methyl]phenol
PubChem CID112613126
Molecular FormulaC14H13FO3
Molecular Weight248.25 g/mol
Exact Mass248.08
IUPAC Name4-[[2-fluoro-6-(hydroxymethyl)phenoxy]methyl]phenol
SMILESOCc1cccc(F)c1OCc1ccc(O)cc1
InChIInChI=1S/C14H13FO3/c15-13-3-1-2-11(8-16)14(13)18-9-10-4-6-12(17)7-5-10/h1-7,16-17H,8-9H2
InChIKeyFYWRGOICMVPXLW-UHFFFAOYSA-N
XLogP2.60
TPSA49.69 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.25
LogP ≤ 52.60
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 4-[[2-fluoro-6-(hydroxymethyl)phenoxy]methyl]phenol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

[2-[(3,4-dimethoxyphenyl)methoxy]-3-fluorophenyl]methanol
CID 115956347
[3-fluoro-2-(phenylmethoxymethoxy)phenyl]methanol
CID 102939875
[2-[(2-chlorophenyl)methoxy]-3-fluorophenyl]methanol
CID 112613091
[3-chloro-2-[(4-fluorophenyl)methoxy]phenyl]methanol
CID 115956286
3-[2-fluoro-6-(hydroxymethyl)phenoxy]propan-1-ol
CID 112612921
[3-fluoro-2-(pyridin-2-ylmethoxy)phenyl]methanol
CID 112613013
[2-[(2,5-dichlorophenyl)methoxy]-3-fluorophenyl]methanol
CID 112612937
[2-[(4-bromo-2-fluorophenyl)methoxy]-3-fluorophenyl]methanol
CID 112613188
[3-fluoro-2-(1,3-thiazol-2-ylmethoxy)phenyl]methanol
CID 112613201
[3-fluoro-2-(quinolin-2-ylmethoxy)phenyl]methanol
CID 115956404
1-(chloromethyl)-2-[(4-ethylphenyl)methoxy]-3-fluorobenzene
CID 112613649
[3-chloro-2-[(3,4-difluorophenyl)methoxy]phenyl]methanol
CID 112612722

Frequently Asked Questions

What is the IUPAC name of 4-[[2-fluoro-6-(hydroxymethyl)phenoxy]methyl]phenol?
The IUPAC name of 4-[[2-fluoro-6-(hydroxymethyl)phenoxy]methyl]phenol (CID 112613126) is 4-[[2-fluoro-6-(hydroxymethyl)phenoxy]methyl]phenol.
What is the SMILES notation for 4-[[2-fluoro-6-(hydroxymethyl)phenoxy]methyl]phenol?
The canonical SMILES for 4-[[2-fluoro-6-(hydroxymethyl)phenoxy]methyl]phenol is OCc1cccc(F)c1OCc1ccc(O)cc1.
What is the InChIKey of 4-[[2-fluoro-6-(hydroxymethyl)phenoxy]methyl]phenol?
The InChIKey is FYWRGOICMVPXLW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13FO3/c15-13-3-1-2-11(8-16)14(13)18-9-10-4-6-12(17)7-5-10/h1-7,16-17H,8-9H2.
What are the key properties of 4-[[2-fluoro-6-(hydroxymethyl)phenoxy]methyl]phenol?
4-[[2-fluoro-6-(hydroxymethyl)phenoxy]methyl]phenol has a molecular weight of 248.25 g/mol, XLogP of 2.60, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[[2-fluoro-6-(hydroxymethyl)phenoxy]methyl]phenol is sourced from PubChem (CID 112613126), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).