4-ethenyl-2-ethyl-6-methoxyphenol

C11H14O2 — CID 175119671

IUPAC4-ethenyl-2-ethyl-6-methoxyphenol
SMILESC=Cc1cc(CC)c(O)c(OC)c1
InChIInChI=1S/C11H14O2/c1-4-8-6-9(5-2)11(12)10(7-8)13-3/h4,6-7,12H,1,5H2,2-3H3
InChIKeyBUIMVBPBQQPKOX-UHFFFAOYSA-N
MW178.23 g/mol
LogP2.61
Rot. Bonds3

About 4-ethenyl-2-ethyl-6-methoxyphenol

4-ethenyl-2-ethyl-6-methoxyphenol (PubChem CID 175119671) has the molecular formula C11H14O2 and a molecular weight of 178.23 g/mol. Its IUPAC name is 4-ethenyl-2-ethyl-6-methoxyphenol.

Molecular Properties

Compound Name4-ethenyl-2-ethyl-6-methoxyphenol
PubChem CID175119671
Molecular FormulaC11H14O2
Molecular Weight178.23 g/mol
Exact Mass178.10
IUPAC Name4-ethenyl-2-ethyl-6-methoxyphenol
SMILESC=Cc1cc(CC)c(O)c(OC)c1
InChIInChI=1S/C11H14O2/c1-4-8-6-9(5-2)11(12)10(7-8)13-3/h4,6-7,12H,1,5H2,2-3H3
InChIKeyBUIMVBPBQQPKOX-UHFFFAOYSA-N
XLogP2.61
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms13
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500178.23
LogP ≤ 52.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-ethenyl-2-ethyl-6-methoxyphenol?
The IUPAC name of 4-ethenyl-2-ethyl-6-methoxyphenol (CID 175119671) is 4-ethenyl-2-ethyl-6-methoxyphenol.
What is the SMILES notation for 4-ethenyl-2-ethyl-6-methoxyphenol?
The canonical SMILES for 4-ethenyl-2-ethyl-6-methoxyphenol is C=Cc1cc(CC)c(O)c(OC)c1.
What is the InChIKey of 4-ethenyl-2-ethyl-6-methoxyphenol?
The InChIKey is BUIMVBPBQQPKOX-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14O2/c1-4-8-6-9(5-2)11(12)10(7-8)13-3/h4,6-7,12H,1,5H2,2-3H3.
What are the key properties of 4-ethenyl-2-ethyl-6-methoxyphenol?
4-ethenyl-2-ethyl-6-methoxyphenol has a molecular weight of 178.23 g/mol, XLogP of 2.61, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethenyl-2-ethyl-6-methoxyphenol is sourced from PubChem (CID 175119671), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).