2-ethoxy-4-fluoro-5-methylphenol

C9H11FO2 — CID 125115951

IUPAC2-ethoxy-4-fluoro-5-methylphenol
SMILESCCOc1cc(F)c(C)cc1O
InChIInChI=1S/C9H11FO2/c1-3-12-9-5-7(10)6(2)4-8(9)11/h4-5,11H,3H2,1-2H3
InChIKeyDIUKDROODSQDRE-UHFFFAOYSA-N
MW170.18 g/mol
LogP2.24
Rot. Bonds2

About 2-ethoxy-4-fluoro-5-methylphenol

2-ethoxy-4-fluoro-5-methylphenol (PubChem CID 125115951) has the molecular formula C9H11FO2 and a molecular weight of 170.18 g/mol. Its IUPAC name is 2-ethoxy-4-fluoro-5-methylphenol.

Molecular Properties

Compound Name2-ethoxy-4-fluoro-5-methylphenol
PubChem CID125115951
Molecular FormulaC9H11FO2
Molecular Weight170.18 g/mol
Exact Mass170.07
IUPAC Name2-ethoxy-4-fluoro-5-methylphenol
SMILESCCOc1cc(F)c(C)cc1O
InChIInChI=1S/C9H11FO2/c1-3-12-9-5-7(10)6(2)4-8(9)11/h4-5,11H,3H2,1-2H3
InChIKeyDIUKDROODSQDRE-UHFFFAOYSA-N
XLogP2.24
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500170.18
LogP ≤ 52.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-ethoxy-4,5-difluorophenol
CID 131306358
2-ethoxy-4,5-dimethylphenol
CID 82053903
1-ethoxy-2,5-difluoro-4-methylbenzene
CID 58718803
4-bromo-2-ethoxy-5-fluorophenol
CID 118800387
1,4-diethoxy-2,5-difluorobenzene
CID 58718970
4-fluoro-5-methyl-2-propan-2-yloxyphenol
CID 125116043
5-ethoxy-2,4-difluorophenol
CID 125116194
4,5-dimethyl-2-propoxyphenol
CID 82053946
ethyl 2-ethoxy-3-(5-ethoxy-2-fluoro-4-hydroxyphenyl)propanoate
CID 68617763
5-ethoxy-2-fluoro-3-methylphenol
CID 164891522
5-chloro-4-ethoxy-2-methylphenol
CID 82490779
2-bromo-4-fluoro-5-methylphenol
CID 84672831

Frequently Asked Questions

What is the IUPAC name of 2-ethoxy-4-fluoro-5-methylphenol?
The IUPAC name of 2-ethoxy-4-fluoro-5-methylphenol (CID 125115951) is 2-ethoxy-4-fluoro-5-methylphenol.
What is the SMILES notation for 2-ethoxy-4-fluoro-5-methylphenol?
The canonical SMILES for 2-ethoxy-4-fluoro-5-methylphenol is CCOc1cc(F)c(C)cc1O.
What is the InChIKey of 2-ethoxy-4-fluoro-5-methylphenol?
The InChIKey is DIUKDROODSQDRE-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H11FO2/c1-3-12-9-5-7(10)6(2)4-8(9)11/h4-5,11H,3H2,1-2H3.
What are the key properties of 2-ethoxy-4-fluoro-5-methylphenol?
2-ethoxy-4-fluoro-5-methylphenol has a molecular weight of 170.18 g/mol, XLogP of 2.24, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethoxy-4-fluoro-5-methylphenol is sourced from PubChem (CID 125115951), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).