2-fluoro-6-(hydroxymethyl)-4-methylphenol

C8H9FO2 — CID 84650325

IUPAC2-fluoro-6-(hydroxymethyl)-4-methylphenol
SMILESCc1cc(F)c(O)c(CO)c1
InChIInChI=1S/C8H9FO2/c1-5-2-6(4-10)8(11)7(9)3-5/h2-3,10-11H,4H2,1H3
InChIKeyXYQFWUZFILCCMC-UHFFFAOYSA-N
MW156.16 g/mol
LogP1.33
Rot. Bonds1

About 2-fluoro-6-(hydroxymethyl)-4-methylphenol

2-fluoro-6-(hydroxymethyl)-4-methylphenol (PubChem CID 84650325) has the molecular formula C8H9FO2 and a molecular weight of 156.16 g/mol. Its IUPAC name is 2-fluoro-6-(hydroxymethyl)-4-methylphenol.

Molecular Properties

Compound Name2-fluoro-6-(hydroxymethyl)-4-methylphenol
PubChem CID84650325
Molecular FormulaC8H9FO2
Molecular Weight156.16 g/mol
Exact Mass156.06
IUPAC Name2-fluoro-6-(hydroxymethyl)-4-methylphenol
SMILESCc1cc(F)c(O)c(CO)c1
InChIInChI=1S/C8H9FO2/c1-5-2-6(4-10)8(11)7(9)3-5/h2-3,10-11H,4H2,1H3
InChIKeyXYQFWUZFILCCMC-UHFFFAOYSA-N
XLogP1.33
TPSA40.46 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500156.16
LogP ≤ 51.33
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-fluoro-6-(3-hydroxypropyl)-4-methylphenol
CID 117279810
2,6-difluoro-4-methylphenol;rutherfordium
CID 59884291
2-fluoro-3-(hydroxymethyl)-5-methylphenol
CID 117276057
(3-bromo-2-(19F)fluoro-5-methylphenyl)methanol
CID 101070863
3-(3-fluoro-2-hydroxy-5-methylphenyl)-2,2-dimethylpropanoic acid
CID 117325436
3-fluoro-4-hydroxy-5-(hydroxymethyl)benzonitrile
CID 131537406
2,6-difluoro-4-methylphenol;prop-1-yne
CID 143527577
(2,5-dimethylphenyl)methanol;bis(2-fluoro-1,4-dimethylbenzene);1,4-xylene
CID 158726026
2,6-bis[[5-(aminomethyl)-2-hydroxy-3-(hydroxymethyl)phenyl]methyl]-4-methylphenol
CID 151086831
5-(hydroxymethyl)-4-methylbenzene-1,2,3-triol
CID 123599997
4-bromo-2-fluoro-6-(hydroxymethyl)benzene-1,3-diol
CID 84798374
1-hydroxy-1-[2-hydroxy-3-(hydroxymethyl)-5-methylphenyl]propan-2-one
CID 70849781

Frequently Asked Questions

What is the IUPAC name of 2-fluoro-6-(hydroxymethyl)-4-methylphenol?
The IUPAC name of 2-fluoro-6-(hydroxymethyl)-4-methylphenol (CID 84650325) is 2-fluoro-6-(hydroxymethyl)-4-methylphenol.
What is the SMILES notation for 2-fluoro-6-(hydroxymethyl)-4-methylphenol?
The canonical SMILES for 2-fluoro-6-(hydroxymethyl)-4-methylphenol is Cc1cc(F)c(O)c(CO)c1.
What is the InChIKey of 2-fluoro-6-(hydroxymethyl)-4-methylphenol?
The InChIKey is XYQFWUZFILCCMC-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H9FO2/c1-5-2-6(4-10)8(11)7(9)3-5/h2-3,10-11H,4H2,1H3.
What are the key properties of 2-fluoro-6-(hydroxymethyl)-4-methylphenol?
2-fluoro-6-(hydroxymethyl)-4-methylphenol has a molecular weight of 156.16 g/mol, XLogP of 1.33, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-fluoro-6-(hydroxymethyl)-4-methylphenol is sourced from PubChem (CID 84650325), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).