4-(2,4-dimethoxyphenyl)-3-fluorophenol

C14H13FO3 — CID 53219547

IUPAC4-(2,4-dimethoxyphenyl)-3-fluorophenol
SMILESCOc1ccc(-c2ccc(O)cc2F)c(OC)c1
InChIInChI=1S/C14H13FO3/c1-17-10-4-6-12(14(8-10)18-2)11-5-3-9(16)7-13(11)15/h3-8,16H,1-2H3
InChIKeyYTCDDPREFGFYIF-UHFFFAOYSA-N
MW248.25 g/mol
LogP3.22
Rot. Bonds3

About 4-(2,4-dimethoxyphenyl)-3-fluorophenol

4-(2,4-dimethoxyphenyl)-3-fluorophenol (PubChem CID 53219547) has the molecular formula C14H13FO3 and a molecular weight of 248.25 g/mol. Its IUPAC name is 4-(2,4-dimethoxyphenyl)-3-fluorophenol.

Molecular Properties

Compound Name4-(2,4-dimethoxyphenyl)-3-fluorophenol
PubChem CID53219547
Molecular FormulaC14H13FO3
Molecular Weight248.25 g/mol
Exact Mass248.08
IUPAC Name4-(2,4-dimethoxyphenyl)-3-fluorophenol
SMILESCOc1ccc(-c2ccc(O)cc2F)c(OC)c1
InChIInChI=1S/C14H13FO3/c1-17-10-4-6-12(14(8-10)18-2)11-5-3-9(16)7-13(11)15/h3-8,16H,1-2H3
InChIKeyYTCDDPREFGFYIF-UHFFFAOYSA-N
XLogP3.22
TPSA38.69 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.25
LogP ≤ 53.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-fluoro-4-(2-methoxyphenyl)phenol
CID 53219300
4-(2,4-dimethoxyphenyl)-3-fluorobenzoic acid
CID 53211675
4-(2,4-dimethoxyphenyl)-3-ethoxyphenol
CID 54469913
3-fluoro-4-methoxyphenol
CID 14661613
3-fluoro-4-(4-fluoro-3-methoxyphenyl)phenol
CID 53219460
5-(2,4-dimethoxyphenyl)-4-fluoro-2-methylaniline
CID 107593656
2-(2,4-dimethoxyphenyl)-3,5-dimethoxyphenol
CID 165177874
1-[2-(2,4-dimethoxyphenyl)phenyl]-2,4-dimethoxybenzene
CID 70200625
2-(2-fluoro-4-methoxyphenyl)-4-methylphenol
CID 83130401
5-(2-fluoro-4-methoxyphenyl)-2-methoxyphenol
CID 53220882
3-fluoro-4-(6-methoxy-1,3-benzothiazol-2-yl)phenol
CID 136751643
1-(2,4-dimethoxyphenyl)-2,4-difluoro-5-(4-methoxy-2-propylphenyl)benzene
CID 143904516

Frequently Asked Questions

What is the IUPAC name of 4-(2,4-dimethoxyphenyl)-3-fluorophenol?
The IUPAC name of 4-(2,4-dimethoxyphenyl)-3-fluorophenol (CID 53219547) is 4-(2,4-dimethoxyphenyl)-3-fluorophenol.
What is the SMILES notation for 4-(2,4-dimethoxyphenyl)-3-fluorophenol?
The canonical SMILES for 4-(2,4-dimethoxyphenyl)-3-fluorophenol is COc1ccc(-c2ccc(O)cc2F)c(OC)c1.
What is the InChIKey of 4-(2,4-dimethoxyphenyl)-3-fluorophenol?
The InChIKey is YTCDDPREFGFYIF-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13FO3/c1-17-10-4-6-12(14(8-10)18-2)11-5-3-9(16)7-13(11)15/h3-8,16H,1-2H3.
What are the key properties of 4-(2,4-dimethoxyphenyl)-3-fluorophenol?
4-(2,4-dimethoxyphenyl)-3-fluorophenol has a molecular weight of 248.25 g/mol, XLogP of 3.22, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2,4-dimethoxyphenyl)-3-fluorophenol is sourced from PubChem (CID 53219547), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).