3-ethyl-2-prop-1-enylphenol

C11H14O — CID 172751725

IUPAC3-ethyl-2-prop-1-enylphenol
SMILESCC=Cc1c(O)cccc1CC
InChIInChI=1S/C11H14O/c1-3-6-10-9(4-2)7-5-8-11(10)12/h3,5-8,12H,4H2,1-2H3
InChIKeyKLTLLYNFRBQHDX-UHFFFAOYSA-N
MW162.23 g/mol
LogP2.99
Rot. Bonds2

About 3-ethyl-2-prop-1-enylphenol

3-ethyl-2-prop-1-enylphenol (PubChem CID 172751725) has the molecular formula C11H14O and a molecular weight of 162.23 g/mol. Its IUPAC name is 3-ethyl-2-prop-1-enylphenol.

Molecular Properties

Compound Name3-ethyl-2-prop-1-enylphenol
PubChem CID172751725
Molecular FormulaC11H14O
Molecular Weight162.23 g/mol
Exact Mass162.10
IUPAC Name3-ethyl-2-prop-1-enylphenol
SMILESCC=Cc1c(O)cccc1CC
InChIInChI=1S/C11H14O/c1-3-6-10-9(4-2)7-5-8-11(10)12/h3,5-8,12H,4H2,1-2H3
InChIKeyKLTLLYNFRBQHDX-UHFFFAOYSA-N
XLogP2.99
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500162.23
LogP ≤ 52.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

3-octyl-2-prop-1-enylphenol
CID 70012746
2-(aminomethyl)-3-ethylphenol
CID 21467751
benzene;2-ethylphenol
CID 159726745
4-octyl-2,3-bis(prop-1-enyl)phenol
CID 70147182
magnesium;2-ethylphenol;chloride
CID 173391731
carbamic acid;2,3-diethylphenol;methanamine
CID 174684713
2-(3-amino-2-prop-1-enylphenyl)ethanol
CID 154369612
3-ethyl-2-(2-ethyl-3-hydroxyphenyl)phenol
CID 101302719
1-ethyl-2-(2-prop-1-enylphenyl)benzene
CID 91183008
2,3-bis[(2,3,4-triethylphenyl)methyl]phenol
CID 67181329
methyl 3-(hydroxymethyl)-2-prop-1-enylbenzoate
CID 142678994
2-ethylphenol;N-methylmethanamine
CID 118325670

Frequently Asked Questions

What is the IUPAC name of 3-ethyl-2-prop-1-enylphenol?
The IUPAC name of 3-ethyl-2-prop-1-enylphenol (CID 172751725) is 3-ethyl-2-prop-1-enylphenol.
What is the SMILES notation for 3-ethyl-2-prop-1-enylphenol?
The canonical SMILES for 3-ethyl-2-prop-1-enylphenol is CC=Cc1c(O)cccc1CC.
What is the InChIKey of 3-ethyl-2-prop-1-enylphenol?
The InChIKey is KLTLLYNFRBQHDX-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14O/c1-3-6-10-9(4-2)7-5-8-11(10)12/h3,5-8,12H,4H2,1-2H3.
What are the key properties of 3-ethyl-2-prop-1-enylphenol?
3-ethyl-2-prop-1-enylphenol has a molecular weight of 162.23 g/mol, XLogP of 2.99, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethyl-2-prop-1-enylphenol is sourced from PubChem (CID 172751725), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).