ethane;2,3,4-triethyl-5-fluorophenol

C14H23FO — CID 143347734

IUPACethane;2,3,4-triethyl-5-fluorophenol
SMILESCC.CCc1c(O)cc(F)c(CC)c1CC
InChIInChI=1S/C12H17FO.C2H6/c1-4-8-9(5-2)11(13)7-12(14)10(8)6-3;1-2/h7,14H,4-6H2,1-3H3;1-2H3
InChIKeyMBVYKNRZCFKGHS-UHFFFAOYSA-N
MW226.33 g/mol
LogP4.24
Rot. Bonds3

About ethane;2,3,4-triethyl-5-fluorophenol

ethane;2,3,4-triethyl-5-fluorophenol (PubChem CID 143347734) has the molecular formula C14H23FO and a molecular weight of 226.33 g/mol. Its IUPAC name is ethane;2,3,4-triethyl-5-fluorophenol.

Molecular Properties

Compound Nameethane;2,3,4-triethyl-5-fluorophenol
PubChem CID143347734
Molecular FormulaC14H23FO
Molecular Weight226.33 g/mol
Exact Mass226.17
IUPAC Nameethane;2,3,4-triethyl-5-fluorophenol
SMILESCC.CCc1c(O)cc(F)c(CC)c1CC
InChIInChI=1S/C12H17FO.C2H6/c1-4-8-9(5-2)11(13)7-12(14)10(8)6-3;1-2/h7,14H,4-6H2,1-3H3;1-2H3
InChIKeyMBVYKNRZCFKGHS-UHFFFAOYSA-N
XLogP4.24
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.33
LogP ≤ 54.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

2-ethyl-3,5-difluorophenol
CID 131273539
5-amino-2,3,4-triethylphenol
CID 118234827
ethane;4-ethyl-3-fluoro-5-methylnaphthalene-1,7-diol
CID 176951343
2-ethyl-4,6-difluoro-3-methylphenol
CID 134178031
2-ethyl-3,4-difluorophenol
CID 130218632
ethane;2-ethyl-1,5-difluoro-3-methylbenzene
CID 142885639
ethane;2-ethyl-1-fluoro-3,5-dimethylbenzene
CID 170736558
2-ethyl-1,3-difluoro-5-prop-1-en-2-ylbenzene
CID 170266078
ethane;4-ethyl-5-methoxybenzene-1,3-diol
CID 153353458
3-chloro-2-ethyl-4-fluorophenol
CID 75365718
2-ethyl-5-(4-ethyl-3-hydroxy-5-methylphenyl)-3-methylphenol
CID 134165367
2,3-dichloro-4-ethyl-1,5-difluorobenzene
CID 155190047

Frequently Asked Questions

What is the IUPAC name of ethane;2,3,4-triethyl-5-fluorophenol?
The IUPAC name of ethane;2,3,4-triethyl-5-fluorophenol (CID 143347734) is ethane;2,3,4-triethyl-5-fluorophenol.
What is the SMILES notation for ethane;2,3,4-triethyl-5-fluorophenol?
The canonical SMILES for ethane;2,3,4-triethyl-5-fluorophenol is CC.CCc1c(O)cc(F)c(CC)c1CC.
What is the InChIKey of ethane;2,3,4-triethyl-5-fluorophenol?
The InChIKey is MBVYKNRZCFKGHS-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H17FO.C2H6/c1-4-8-9(5-2)11(13)7-12(14)10(8)6-3;1-2/h7,14H,4-6H2,1-3H3;1-2H3.
What are the key properties of ethane;2,3,4-triethyl-5-fluorophenol?
ethane;2,3,4-triethyl-5-fluorophenol has a molecular weight of 226.33 g/mol, XLogP of 4.24, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;2,3,4-triethyl-5-fluorophenol is sourced from PubChem (CID 143347734), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).