5-ethyl-3-fluoro-2-methoxyphenol

C9H11FO2 — CID 84653744

IUPAC5-ethyl-3-fluoro-2-methoxyphenol
SMILESCCc1cc(O)c(OC)c(F)c1
InChIInChI=1S/C9H11FO2/c1-3-6-4-7(10)9(12-2)8(11)5-6/h4-5,11H,3H2,1-2H3
InChIKeyKFCBSCNAXLILEP-UHFFFAOYSA-N
MW170.18 g/mol
LogP2.10
Rot. Bonds2

About 5-ethyl-3-fluoro-2-methoxyphenol

5-ethyl-3-fluoro-2-methoxyphenol (PubChem CID 84653744) has the molecular formula C9H11FO2 and a molecular weight of 170.18 g/mol. Its IUPAC name is 5-ethyl-3-fluoro-2-methoxyphenol.

Molecular Properties

Compound Name5-ethyl-3-fluoro-2-methoxyphenol
PubChem CID84653744
Molecular FormulaC9H11FO2
Molecular Weight170.18 g/mol
Exact Mass170.07
IUPAC Name5-ethyl-3-fluoro-2-methoxyphenol
SMILESCCc1cc(O)c(OC)c(F)c1
InChIInChI=1S/C9H11FO2/c1-3-6-4-7(10)9(12-2)8(11)5-6/h4-5,11H,3H2,1-2H3
InChIKeyKFCBSCNAXLILEP-UHFFFAOYSA-N
XLogP2.10
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 ≤ 52.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(3-fluoro-5-hydroxy-4-methoxyphenyl)propan-2-one
CID 117287591
1-(5-ethyl-3-fluoro-2-methoxyphenyl)ethanol
CID 84668298
3-fluoro-5-(isocyanatomethyl)-2-methoxyphenol
CID 117286579
5-ethyl-1,3-difluoro-2-(trifluoromethoxy)benzene
CID 56617585
3-fluoro-2-methoxy-5-(piperazin-1-ylmethyl)phenol
CID 117353440
3-amino-1-(5-ethyl-3-fluoro-2-methoxyphenyl)propan-1-one
CID 117323328
3-ethyl-6-methoxynaphthalen-1-ol
CID 10442833
2,5-diethyl-1-fluoro-3-methoxybenzene
CID 175600199
2-(3-fluoro-5-hydroxy-4-methoxyphenyl)-2-oxoacetic acid
CID 117304900
5-ethyl-2-fluoro-3-methylphenol
CID 89028057
4-[(5-ethyl-3-fluoro-2-methoxyphenyl)methyl]piperidine
CID 117382042
1-[(5-ethyl-3-fluoro-2-methoxyphenyl)methyl]piperazine
CID 117384414

Frequently Asked Questions

What is the IUPAC name of 5-ethyl-3-fluoro-2-methoxyphenol?
The IUPAC name of 5-ethyl-3-fluoro-2-methoxyphenol (CID 84653744) is 5-ethyl-3-fluoro-2-methoxyphenol.
What is the SMILES notation for 5-ethyl-3-fluoro-2-methoxyphenol?
The canonical SMILES for 5-ethyl-3-fluoro-2-methoxyphenol is CCc1cc(O)c(OC)c(F)c1.
What is the InChIKey of 5-ethyl-3-fluoro-2-methoxyphenol?
The InChIKey is KFCBSCNAXLILEP-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H11FO2/c1-3-6-4-7(10)9(12-2)8(11)5-6/h4-5,11H,3H2,1-2H3.
What are the key properties of 5-ethyl-3-fluoro-2-methoxyphenol?
5-ethyl-3-fluoro-2-methoxyphenol has a molecular weight of 170.18 g/mol, XLogP of 2.10, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-ethyl-3-fluoro-2-methoxyphenol is sourced from PubChem (CID 84653744), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).